data_1ezy_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 1ezy _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 6' ' ' SER . . . . . 0.417 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 53.0 p . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.196 -0.668 . . . . 15.970000000000001 109.196 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' O ' ' OE2' ' A' ' 15' ' ' GLU . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.2599999999999998 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.409 ' CD1' ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.401 ' H ' ' HG ' ' A' ' 16' ' ' SER . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.469 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.54 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.54 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.469 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.448 HD22 HD22 ' A' ' 82' ' ' ASN . 93.3 m-20 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HZ2' ' CB ' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.476 ' HG1' ' N ' ' A' ' 79' ' ' LYS . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.476 ' N ' ' HG1' ' A' ' 78' ' ' THR . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.448 HD22 HD22 ' A' ' 42' ' ' ASN . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.546 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.553 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.669 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.669 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.483 ' HG2' HH11 ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.451 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.8700000000000001 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.5 p . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.6299999999999999 109.516 -179.66 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 121.227 0.537 . . . . 15.970000000000001 109.633 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.536 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' CB ' ' NZ ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.2599999999999998 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.4 ' CD2' ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.752 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.752 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.416 ' N ' ' O ' ' A' ' 26' ' ' GLY . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 37' ' ' GLU . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.549 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.499 ' CD1' ' HZ1' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.499 ' HZ1' ' CD1' ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.409 ' H ' ' C ' ' A' ' 74' ' ' SER . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.445 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.454 ' HG2' HH11 ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.416 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.409 ' CB ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.434 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.434 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.8700000000000001 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 128' ' ' TYR . 6.8 p . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.6299999999999999 109.44 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.484 ' HG ' ' H ' ' A' ' 9' ' ' GLU . 80.0 p . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 121.491 0.662 . . . . 15.970000000000001 109.97 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.484 ' H ' ' HG ' ' A' ' 6' ' ' SER . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.2599999999999998 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.521 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.452 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.521 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 26' ' ' GLY . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.555 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.402 HG21 HD11 ' A' ' 47' ' ' ILE . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.505 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.625 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.616 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.646 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.724 ' HG1' ' HZ3' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.555 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.528 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.555 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.505 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.724 ' HZ3' ' HG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.553 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.8700000000000001 109.078 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.6299999999999999 110.004 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 108.845 -0.798 . . . . 15.970000000000001 108.845 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.2599999999999998 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.434 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.453 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 26' ' ' GLY . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.414 ' CB ' ' NZ ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.506 ' O ' ' N ' ' A' ' 38' ' ' TYR . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' ' OG ' ' A' ' 39' ' ' SER . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.421 HD22 HD22 ' A' ' 82' ' ' ASN . 98.4 m-20 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.46 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.46 ' N ' ' HG ' ' A' ' 48' ' ' SER . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.415 HD13 HG22 ' A' ' 68' ' ' ILE . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.464 ' O ' ' OG ' ' A' ' 74' ' ' SER . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.442 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.553 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.435 ' O ' ' OG ' ' A' ' 92' ' ' SER . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.499 ' HG2' HH11 ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.553 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.485 ' O ' ' OG ' ' A' ' 118' ' ' SER . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.468 ' HG2' HH11 ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 126' ' ' ARG . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.8700000000000001 108.697 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 80.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.6299999999999999 108.122 179.704 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 109.49 -0.559 . . . . 15.970000000000001 109.49 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' NZ ' ' O ' ' A' ' 7' ' ' GLN . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.2599999999999998 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.498 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.528 ' O ' ' N ' ' A' ' 38' ' ' TYR . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.577 ' HG ' HD21 ' A' ' 42' ' ' ASN . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.542 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.702 HD22 HD22 ' A' ' 82' ' ' ASN . 97.9 m-20 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.601 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.601 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.495 ' N ' ' HZ1' ' A' ' 64' ' ' LYS . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.425 ' CD1' ' HZ2' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HZ1' ' N ' ' A' ' 52' ' ' TYR . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.668 ' HG ' ' H ' ' A' ' 76' ' ' GLN . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.668 ' H ' ' HG ' ' A' ' 74' ' ' SER . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.702 HD22 HD22 ' A' ' 42' ' ' ASN . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.554 ' HG1' ' HZ2' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.445 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.616 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.616 ' N ' ' HG ' ' A' ' 92' ' ' SER . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.554 ' HZ2' ' HG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HG3' ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.8700000000000001 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.6299999999999999 109.743 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.492 1.625 0 N-CA-C 109.243 -0.651 . . . . 15.970000000000001 109.243 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.494 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.2599999999999998 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.601 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.415 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.601 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.502 ' N ' ' O ' ' A' ' 26' ' ' GLY . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 38' ' ' TYR . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.557 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.557 ' ND2' ' OG ' ' A' ' 39' ' ' SER . 98.6 m-20 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.583 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.583 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.488 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.424 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 29.1 m120 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.42 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.476 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.449 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.48 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.48 ' N ' ' HG ' ' A' ' 92' ' ' SER . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.468 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.62 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.62 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.8700000000000001 109.792 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 64.1 p . . . . . 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.6299999999999999 110.145 -179.342 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 121.428 0.633 . . . . 15.970000000000001 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.2599999999999998 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.483 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.483 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 94.2 m-20 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.3 m120 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.51 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' C ' ' HZ3' ' A' ' 31' ' ' LYS . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.468 ' N ' ' O ' ' A' ' 26' ' ' GLY . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.531 ' HZ3' ' C ' ' A' ' 27' ' ' LEU . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.556 ' O ' ' N ' ' A' ' 38' ' ' TYR . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 70' ' ' ASN . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 66' ' ' LYS . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.498 ' CG ' ' HG1' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.498 ' HG1' ' CG ' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.506 ' HG2' HH11 ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HZ3' ' CB ' ' A' ' 108' ' ' LYS . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 113' ' ' LEU . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.541 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.541 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.552 ' O ' ' N ' ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.8700000000000001 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.552 ' N ' ' O ' ' A' ' 128' ' ' TYR . 20.6 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.6299999999999999 109.211 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 121.295 0.569 . . . . 15.970000000000001 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HZ2' ' CA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.2599999999999998 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.466 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.3 m120 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.466 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CB ' ' O ' ' A' ' 26' ' ' GLY . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.432 ' CE1' ' OG ' ' A' ' 125' ' ' SER . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 37' ' ' GLU . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 47' ' ' ILE . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.597 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.555 ' HZ3' ' CB ' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.548 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.548 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 5.1 p30 -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.526 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.423 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.526 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.531 ' HG2' HH11 ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.8700000000000001 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 22.2 p . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.6299999999999999 110.189 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.353 -0.61 . . . . 15.970000000000001 109.353 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.422 ' CG2' ' N ' ' A' ' 11' ' ' LYS . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' ' CG2' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.2599999999999998 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.609 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.609 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.43 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 38' ' ' TYR . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.433 ' N ' HD21 ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.526 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.526 ' N ' ' HG ' ' A' ' 48' ' ' SER . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.565 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.408 HD11 HG23 ' A' ' 68' ' ' ILE . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.503 ' NH1' ' CG2' ' A' ' 87' ' ' THR . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.408 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.415 ' HB3' HH22 ' A' ' 88' ' ' ARG . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.565 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 17.6 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.425 ' C ' ' CD1' ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.497 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.8700000000000001 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 128' ' ' TYR . 17.7 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.6299999999999999 109.347 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.361 0.601 . . . . 15.970000000000001 109.674 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.512 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.537 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.2599999999999998 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.584 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.584 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.487 ' N ' ' O ' ' A' ' 26' ' ' GLY . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.652 HD22 HD22 ' A' ' 82' ' ' ASN . 96.1 m-20 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.58 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.522 ' CD1' ' HZ2' ' A' ' 64' ' ' LYS . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.522 ' HZ2' ' CD1' ' A' ' 55' ' ' ILE . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.42 ' N ' ' O ' ' A' ' 65' ' ' ALA . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.443 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.652 HD22 HD22 ' A' ' 42' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.443 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.541 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.541 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.58 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 43.2 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.537 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.468 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.534 ' O ' ' N ' ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.8700000000000001 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.534 ' N ' ' O ' ' A' ' 128' ' ' TYR . 40.0 p . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.6299999999999999 109.183 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.565 -0.531 . . . . 15.970000000000001 109.565 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.2599999999999998 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.605 ' HG ' ' ND2' ' A' ' 19' ' ' ASN . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.605 ' ND2' ' HG ' ' A' ' 16' ' ' SER . 91.3 m-20 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.578 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.478 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.578 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.481 ' N ' ' O ' ' A' ' 26' ' ' GLY . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.422 ' O ' ' N ' ' A' ' 37' ' ' GLU . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.513 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.674 HD22 ' ND2' ' A' ' 82' ' ' ASN . 98.5 m-20 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HZ1' ' CD ' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.441 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.441 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.674 ' ND2' HD22 ' A' ' 42' ' ' ASN . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CE2' ' A' ' 103' ' ' PHE . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CE2' ' SG ' ' A' ' 102' ' ' CYS . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.491 ' CD ' ' HZ1' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.486 ' O ' ' OG ' ' A' ' 118' ' ' SER . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HG2' HH11 ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.8700000000000001 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.6299999999999999 108.923 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 121.445 0.641 . . . . 15.970000000000001 109.365 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.471 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.2599999999999998 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.1 m120 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.85 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.85 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.63 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.63 ' N ' ' HG ' ' A' ' 48' ' ' SER . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.466 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.466 ' N ' ' HG ' ' A' ' 59' ' ' SER . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.429 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' N ' ' O ' ' A' ' 65' ' ' ALA . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.442 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.417 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.469 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.469 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' CD2' ' C ' ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.469 ' NH1' ' CB ' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.464 ' HG2' HH11 ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.474 ' O ' ' N ' ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.8700000000000001 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 128' ' ' TYR . 30.5 p . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.6299999999999999 108.649 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 109.196 -0.668 . . . . 15.970000000000001 109.196 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.2599999999999998 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.7 m120 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.517 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.409 ' N ' ' O ' ' A' ' 26' ' ' GLY . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.668 HD22 HD22 ' A' ' 82' ' ' ASN . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.642 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.584 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ3' ' CD1' ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.424 HG22 HD13 ' A' ' 68' ' ' ILE . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.404 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.668 HD22 HD22 ' A' ' 42' ' ' ASN . 5.2 p30 -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.418 ' HG2' HH11 ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.642 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.6 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.6 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.8700000000000001 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 9.3 p . . . . . 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.6299999999999999 108.943 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.52 0.676 . . . . 15.970000000000001 110.172 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.2599999999999998 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.423 ' CD1' ' CZ ' ' A' ' 111' ' ' PHE . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.663 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.663 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.528 ' N ' ' O ' ' A' ' 26' ' ' GLY . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 38' ' ' TYR . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.525 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.496 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.667 HD22 HD22 ' A' ' 82' ' ' ASN . 99.2 m-20 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.55 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.411 ' HH ' ' CB ' ' A' ' 102' ' ' CYS . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ1' ' CD1' ' A' ' 68' ' ' ILE . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.447 ' CD1' ' HZ1' ' A' ' 64' ' ' LYS . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.417 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.667 HD22 HD22 ' A' ' 42' ' ' ASN . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.411 ' CB ' ' HH ' ' A' ' 52' ' ' TYR . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.423 ' CZ ' ' CD1' ' A' ' 21' ' ' ILE . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.466 ' HG2' HH11 ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.521 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.8700000000000001 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.521 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.6299999999999999 109.348 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.121 -0.696 . . . . 15.970000000000001 109.121 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.539 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' GLU . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.52 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.2599999999999998 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 12' ' ' LYS . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.64 ' HD1' ' N ' ' A' ' 25' ' ' CYS . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.64 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.505 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.478 ' N ' ' O ' ' A' ' 26' ' ' GLY . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD1' ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.427 ' SG ' ' OE1' ' A' ' 107' ' ' GLN . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' HZ1' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.488 ' N ' ' O ' ' A' ' 65' ' ' ALA . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.44 ' O ' ' OG ' ' A' ' 74' ' ' SER . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 42' ' ' ASN . 0.1 OUTLIER -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.453 ' O ' ' OG ' ' A' ' 92' ' ' SER . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.422 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.422 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.594 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.55 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.427 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.467 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.52 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.697 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.534 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.8700000000000001 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.534 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p . . . . . 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.6299999999999999 110.427 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.445 -0.946 . . . . 15.970000000000001 108.445 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.2599999999999998 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.43 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.43 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.601 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.601 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.443 ' O ' ' OG ' ' A' ' 74' ' ' SER . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.622 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.447 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' OG ' ' A' ' 92' ' ' SER . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.455 ' HG2' HH11 ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.498 ' OD1' ' SG ' ' A' ' 102' ' ' CYS . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.601 ' SD ' ' N ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.498 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.578 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.578 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.406 ' NH1' ' HG2' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.842 ' HE ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.465 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.8700000000000001 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.465 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 16.7 p . . . . . 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.6299999999999999 109.754 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.24 -1.022 . . . . 15.970000000000001 108.24 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.489 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.2599999999999998 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 19' ' ' ASN . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.627 ' HG ' ' ND2' ' A' ' 19' ' ' ASN . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.627 ' ND2' ' HG ' ' A' ' 16' ' ' SER . 91.5 m-20 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.562 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.562 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 26' ' ' GLY . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.474 ' H ' ' HG ' ' A' ' 39' ' ' SER . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.405 HG22 ' N ' ' A' ' 44' ' ' ASP . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.405 ' N ' HG22 ' A' ' 43' ' ' ILE . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.451 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.503 ' SG ' ' OE1' ' A' ' 107' ' ' GLN . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.537 ' HZ1' ' CB ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.434 HD12 HG21 ' A' ' 68' ' ' ILE . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.43 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.422 ' HG1' ' HG3' ' A' ' 109' ' ' LYS . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.439 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.428 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.505 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.505 ' N ' ' HG ' ' A' ' 92' ' ' SER . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.537 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.503 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.422 ' HG3' ' HG1' ' A' ' 87' ' ' THR . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.489 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.582 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.8700000000000001 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.582 ' N ' ' O ' ' A' ' 128' ' ' TYR . 6.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.6299999999999999 108.712 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.113 -0.699 . . . . 15.970000000000001 109.113 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.401 ' CD1' ' N ' ' A' ' 13' ' ' TRP . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.2599999999999998 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.441 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.528 ' N ' ' O ' ' A' ' 26' ' ' GLY . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.401 ' HZ2' ' NE2' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.416 HD13 HG23 ' A' ' 68' ' ' ILE . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.409 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.604 ' HG ' ' H ' ' A' ' 76' ' ' GLN . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.604 ' H ' ' HG ' ' A' ' 74' ' ' SER . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.401 ' NE2' ' HZ2' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.48 ' N ' ' OG ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.439 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.8700000000000001 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.4 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.6299999999999999 108.561 179.629 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.135 -0.691 . . . . 15.970000000000001 109.135 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.2599999999999998 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' CD2' ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.409 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.423 ' N ' ' O ' ' A' ' 26' ' ' GLY . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 38' ' ' TYR . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.555 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.521 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.446 ' OE2' ' O ' ' A' ' 74' ' ' SER . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.495 ' N ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.434 ' HG2' HH11 ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.521 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.581 ' ND2' ' HZ3' ' A' ' 116' ' ' LYS . 20.3 m120 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' ' CD2' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . 0.581 ' HZ3' ' ND2' ' A' ' 112' ' ' ASN . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 114' ' ' MET . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.409 ' NH1' ' HG2' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.8700000000000001 108.01 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.617 ' N ' ' O ' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.6299999999999999 107.911 179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.706 0.765 . . . . 15.970000000000001 110.042 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.2599999999999998 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.501 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.501 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.0 m-20 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 6.0 m120 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.422 ' N ' ' O ' ' A' ' 26' ' ' GLY . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 38' ' ' TYR . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.57 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.591 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.586 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.432 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' ' OG ' ' A' ' 92' ' ' SER . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.591 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 24.9 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.411 HH11 ' HG3' ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.8700000000000001 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 36.0 p . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.6299999999999999 110.946 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.247 0.546 . . . . 15.970000000000001 109.923 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.467 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.2599999999999998 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.488 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.68 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.442 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.68 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 26' ' ' GLY . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.528 ' CB ' HD21 ' A' ' 42' ' ' ASN . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.599 HD22 ' ND2' ' A' ' 82' ' ' ASN . 81.7 m-20 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.413 HG22 HD13 ' A' ' 55' ' ' ILE . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 65' ' ' ALA . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.599 ' ND2' HD22 ' A' ' 42' ' ' ASN . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' OG ' ' A' ' 92' ' ' SER . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.402 ' CB ' ' HG ' ' A' ' 102' ' ' CYS . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.402 ' HG ' ' CB ' ' A' ' 94' ' ' ASN . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.55 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.485 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.426 ' O ' ' OG ' ' A' ' 118' ' ' SER . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.541 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.424 HH11 ' HG3' ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.8700000000000001 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 43.3 p . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.6299999999999999 109.313 179.572 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.395 0.617 . . . . 15.970000000000001 109.512 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.2599999999999998 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.514 ' N ' ' O ' ' A' ' 26' ' ' GLY . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.524 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.408 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.408 ' N ' ' HG ' ' A' ' 59' ' ' SER . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.466 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' OG ' ' A' ' 92' ' ' SER . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.418 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.603 HD21 ' HZ2' ' A' ' 116' ' ' LYS . 18.6 m120 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . 0.603 ' HZ2' HD21 ' A' ' 112' ' ' ASN . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.466 ' HG2' HH11 ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.8700000000000001 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 25.3 p . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.6299999999999999 110.063 -179.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.35 0.595 . . . . 15.970000000000001 109.776 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.2599999999999998 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 26' ' ' GLY . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.504 HD22 ' ND2' ' A' ' 82' ' ' ASN . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HZ3' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.437 HD11 HG23 ' A' ' 68' ' ' ILE . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.58 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.506 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.506 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.414 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.484 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.531 ' C ' ' HZ3' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.434 ' O ' ' OG ' ' A' ' 118' ' ' SER . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.432 ' H ' ' CD ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.49 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.8700000000000001 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.49 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 4.5 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.6299999999999999 108.797 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.648 0.737 . . . . 15.970000000000001 110.087 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.442 ' CB ' ' HZ1' ' A' ' 12' ' ' LYS . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.2599999999999998 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.494 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.494 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.3 m-20 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.451 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.732 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.732 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' TYR . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.556 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.484 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.484 ' N ' ' HG ' ' A' ' 59' ' ' SER . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.561 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.405 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.625 ' HG1' ' HZ2' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.414 ' O ' ' OG ' ' A' ' 92' ' ' SER . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.556 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.625 ' HZ2' ' HG1' ' A' ' 87' ' ' THR . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.476 ' O ' ' OG ' ' A' ' 118' ' ' SER . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.476 ' OG ' ' O ' ' A' ' 114' ' ' MET . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.578 ' O ' ' N ' ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.8700000000000001 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.578 ' N ' ' O ' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.6299999999999999 108.383 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 121.361 0.601 . . . . 15.970000000000001 109.595 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.421 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.436 ' CB ' ' HZ2' ' A' ' 11' ' ' LYS . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.2599999999999998 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.518 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.717 ' HD1' ' N ' ' A' ' 24' ' ' GLU . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.717 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.502 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' GLY . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' O ' ' N ' ' A' ' 38' ' ' TYR . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.416 HG23 HD11 ' A' ' 47' ' ' ILE . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.468 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 HG21 ' A' ' 68' ' ' ILE . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.498 ' CG ' ' CE ' ' A' ' 95' ' ' MET . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.445 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.597 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.5 ' OD1' ' SG ' ' A' ' 102' ' ' CYS . 9.2 m120 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.5 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.438 ' HZ3' HD22 ' A' ' 112' ' ' ASN . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.517 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.438 HD22 ' HZ3' ' A' ' 108' ' ' LYS . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.574 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.478 ' HG2' HH11 ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.8700000000000001 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 128' ' ' TYR . 63.9 p . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.6299999999999999 110.293 -179.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.363 0.601 . . . . 15.970000000000001 109.61 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.522 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.2599999999999998 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.68 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.536 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.68 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.433 ' O ' ' N ' ' A' ' 38' ' ' TYR . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.721 ' HE1' HE21 ' A' ' 107' ' ' GLN . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.416 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.468 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 76' ' ' GLN . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.558 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.721 HE21 ' HE1' ' A' ' 46' ' ' TRP . 56.2 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.57 ' HZ2' ' ND2' ' A' ' 112' ' ' ASN . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.558 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.57 ' ND2' ' HZ2' ' A' ' 108' ' ' LYS . 98.6 m-20 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.57 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.57 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.522 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.476 ' HG2' HH11 ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.465 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.468 ' NH1' ' CB ' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.559 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.8700000000000001 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.559 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.6299999999999999 106.64 177.621 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 108.815 -0.809 . . . . 15.970000000000001 108.815 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.2599999999999998 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.523 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 97.9 m-20 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 38' ' ' TYR . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.568 HD22 HD22 ' A' ' 82' ' ' ASN . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.626 ' NZ ' ' NE2' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.613 ' CB ' ' HZ3' ' A' ' 60' ' ' LYS . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.613 ' HZ3' ' CB ' ' A' ' 57' ' ' SER . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 68' ' ' ILE . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.568 HD22 HD22 ' A' ' 42' ' ' ASN . 7.3 p30 -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.49 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.45 ' O ' ' OG ' ' A' ' 92' ' ' SER . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.498 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 52.5 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.49 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.413 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.462 ' CD2' ' ND2' ' A' ' 82' ' ' ASN . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 114' ' ' MET . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.535 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.8700000000000001 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.535 ' N ' ' O ' ' A' ' 128' ' ' TYR . 18.8 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.6299999999999999 109.685 -179.391 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.358 -0.608 . . . . 15.970000000000001 109.358 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.2599999999999998 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.42 HD13 HG22 ' A' ' 21' ' ' ILE . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.467 ' N ' ' O ' ' A' ' 26' ' ' GLY . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 38' ' ' TYR . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.432 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.411 HD11 HG23 ' A' ' 55' ' ' ILE . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.507 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' OG ' ' A' ' 92' ' ' SER . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.432 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.507 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.533 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.625 ' NH2' ' HZ1' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.463 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HZ1' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.524 ' CE1' ' OG1' ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.8700000000000001 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.524 ' OG1' ' CE1' ' A' ' 128' ' ' TYR . 11.5 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.6299999999999999 110.332 -179.302 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.179 0.514 . . . . 15.970000000000001 109.629 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.2599999999999998 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.437 ' N ' HD21 ' A' ' 22' ' ' ASN . 2.3 m120 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.748 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.748 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.514 ' N ' ' O ' ' A' ' 26' ' ' GLY . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.457 ' N ' ' O ' ' A' ' 29' ' ' ALA . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 38' ' ' TYR . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.499 ' N ' ' CD ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.436 HG22 HD11 ' A' ' 55' ' ' ILE . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.416 HG23 HD12 ' A' ' 68' ' ' ILE . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.47 ' O ' ' OG ' ' A' ' 74' ' ' SER . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.484 ' HG ' ' N ' ' A' ' 77' ' ' ALA . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.484 ' N ' ' HG ' ' A' ' 74' ' ' SER . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.633 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.633 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.502 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.502 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.509 ' HZ3' ' CB ' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.446 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.562 ' O ' ' N ' ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.8700000000000001 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.562 ' N ' ' O ' ' A' ' 128' ' ' TYR . 5.6 p . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.6299999999999999 108.213 179.637 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.448 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.474 0.654 . . . . 15.970000000000001 110.098 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.556 ' HZ3' ' CB ' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.2599999999999998 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.41 ' N ' ' O ' ' A' ' 26' ' ' GLY . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.708 HD22 HD22 ' A' ' 82' ' ' ASN . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.52 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.609 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.455 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.52 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.708 HD22 HD22 ' A' ' 42' ' ' ASN . 5.5 p30 -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.549 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH1' ' CB ' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.609 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 34.3 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.565 HH21 ' HZ1' ' A' ' 124' ' ' LYS . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.565 ' HZ1' HH21 ' A' ' 120' ' ' ARG . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 128' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.8700000000000001 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 128' ' ' TYR . 30.2 p . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.6299999999999999 109.31 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.544 ' CG2' ' HG ' ' A' ' 25' ' ' CYS . 58.4 t . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.061 -0.718 . . . . 18.699999999999999 109.061 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.417 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 53.0 p -72.9 159.89 33.01 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.195 -0.941 . . . . 15.970000000000001 109.196 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' O ' ' OE2' ' A' ' 15' ' ' GLU . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.2599999999999998 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.409 ' CD1' ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.401 ' H ' ' HG ' ' A' ' 16' ' ' SER . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.469 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.54 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' HG ' ' CG2' ' A' ' 5' ' ' VAL . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.54 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.469 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.448 HD22 HD22 ' A' ' 82' ' ' ASN . 93.3 m-20 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HZ2' ' CB ' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.476 ' HG1' ' N ' ' A' ' 79' ' ' LYS . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.476 ' N ' ' HG1' ' A' ' 78' ' ' THR . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.448 HD22 HD22 ' A' ' 42' ' ' ASN . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.546 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.533 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.553 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.669 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.669 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.483 ' HG2' HH11 ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.451 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.483 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.411 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.8700000000000001 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.5 p -110.11 79.74 1.24 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.6299999999999999 109.516 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 10.9 m120 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.45 -0.944 . . . . 6.4800000000000004 108.45 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.24 -0.652 . . . . 18.699999999999999 109.24 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p -74.4 150.33 40.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.176 -0.952 . . . . 15.970000000000001 109.633 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.536 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' CB ' ' NZ ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.2599999999999998 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.4 ' CD2' ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.752 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.752 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.416 ' N ' ' O ' ' A' ' 26' ' ' GLY . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 37' ' ' GLU . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.549 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.499 ' CD1' ' HZ1' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.499 ' HZ1' ' CD1' ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.409 ' H ' ' C ' ' A' ' 74' ' ' SER . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.445 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.454 ' HG2' HH11 ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.416 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.409 ' CB ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.434 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.434 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.5 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.8700000000000001 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 128' ' ' TYR . 6.8 p -103.22 74.23 1.27 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.6299999999999999 109.44 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 2.3 m-80 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.504 -0.924 . . . . 6.4800000000000004 108.504 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.498 1.94 0 CA-C-O 121.278 0.561 . . . . 18.699999999999999 109.861 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.484 ' HG ' ' H ' ' A' ' 9' ' ' GLU . 80.0 p -75.69 159.18 31.4 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.344 -0.847 . . . . 15.970000000000001 109.97 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.484 ' H ' ' HG ' ' A' ' 6' ' ' SER . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.2599999999999998 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.521 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.452 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.521 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 26' ' ' GLY . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.555 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.402 HG21 HD11 ' A' ' 47' ' ' ILE . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.505 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.625 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.616 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.646 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.724 ' HG1' ' HZ3' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.528 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.555 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.505 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.724 ' HZ3' ' HG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.553 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.8700000000000001 109.078 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 82.0 p -97.29 63.35 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.6299999999999999 110.004 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 107.863 -1.162 . . . . 6.4800000000000004 107.863 179.104 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.449 ' CG2' ' HG ' ' A' ' 25' ' ' CYS . 58.5 t . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 121.347 0.594 . . . . 18.699999999999999 109.636 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -72.07 159.94 33.31 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.4 -0.813 . . . . 15.970000000000001 108.845 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.2599999999999998 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.434 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.449 ' HG ' ' CG2' ' A' ' 5' ' ' VAL . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.453 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 26' ' ' GLY . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.414 ' CB ' ' NZ ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.506 ' O ' ' N ' ' A' ' 38' ' ' TYR . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' ' OG ' ' A' ' 39' ' ' SER . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.421 HD22 HD22 ' A' ' 82' ' ' ASN . 98.4 m-20 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.46 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.46 ' N ' ' HG ' ' A' ' 48' ' ' SER . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.415 HD13 HG22 ' A' ' 68' ' ' ILE . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.464 ' O ' ' OG ' ' A' ' 74' ' ' SER . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.442 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.553 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.435 ' O ' ' OG ' ' A' ' 92' ' ' SER . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.499 ' HG2' HH11 ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.553 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.485 ' O ' ' OG ' ' A' ' 118' ' ' SER . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.468 ' HG2' HH11 ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.506 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.8700000000000001 108.697 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 80.4 p -110.93 80.91 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.6299999999999999 108.122 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.506 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 5.5 m120 . . . . . 0 C--N 1.295 -1.782 0 C-N-CA 119.603 -0.839 . . . . 6.4800000000000004 109.357 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 108.591 -0.892 . . . . 18.699999999999999 108.591 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p -72.13 141.58 49.15 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.112 -0.993 . . . . 15.970000000000001 109.49 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' NZ ' ' O ' ' A' ' 7' ' ' GLN . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.2599999999999998 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.498 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.528 ' O ' ' N ' ' A' ' 38' ' ' TYR . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.577 ' HG ' HD21 ' A' ' 42' ' ' ASN . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.542 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.702 HD22 HD22 ' A' ' 82' ' ' ASN . 97.9 m-20 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.601 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.601 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.495 ' N ' ' HZ1' ' A' ' 64' ' ' LYS . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.425 ' CD1' ' HZ2' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HZ1' ' N ' ' A' ' 52' ' ' TYR . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.668 ' HG ' ' H ' ' A' ' 76' ' ' GLN . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.668 ' H ' ' HG ' ' A' ' 74' ' ' SER . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.702 HD22 HD22 ' A' ' 42' ' ' ASN . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.554 ' HG1' ' HZ2' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.445 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.616 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.616 ' N ' ' HG ' ' A' ' 92' ' ' SER . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.554 ' HZ2' ' HG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HG3' ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.8700000000000001 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p -113.17 80.66 1.38 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.6299999999999999 109.743 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 21.1 m120 . . . . . 0 C--N 1.294 -1.816 0 O-C-N 120.819 -1.176 . . . . 6.4800000000000004 107.954 179.509 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.484 ' CG2' ' HG ' ' A' ' 25' ' ' CYS . 52.9 t . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.223 -0.658 . . . . 18.699999999999999 109.223 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p -73.46 157.14 37.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.164 -0.96 . . . . 15.970000000000001 109.243 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 133' ' ' ASN . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.494 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.2599999999999998 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.601 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.484 ' HG ' ' CG2' ' A' ' 5' ' ' VAL . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.601 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.502 ' N ' ' O ' ' A' ' 26' ' ' GLY . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 38' ' ' TYR . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.557 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.557 ' ND2' ' OG ' ' A' ' 39' ' ' SER . 98.6 m-20 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.583 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.583 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.488 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.424 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 29.1 m120 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.42 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.476 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.449 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.48 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.48 ' N ' ' HG ' ' A' ' 92' ' ' SER . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.468 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.62 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.62 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.8700000000000001 109.792 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 64.1 p -94.36 61.05 2.76 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.6299999999999999 110.145 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 2.1 m120 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.392 -0.817 . . . . 6.4800000000000004 108.852 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.498 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 34.0 t . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 108.49 -0.93 . . . . 18.699999999999999 108.49 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p -71.38 160.26 33.08 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.356 -0.84 . . . . 15.970000000000001 109.566 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.2599999999999998 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.483 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.483 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 94.2 m-20 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.3 m120 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.498 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.51 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' C ' ' HZ3' ' A' ' 31' ' ' LYS . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.468 ' N ' ' O ' ' A' ' 26' ' ' GLY . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.531 ' HZ3' ' C ' ' A' ' 27' ' ' LEU . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.556 ' O ' ' N ' ' A' ' 38' ' ' TYR . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 70' ' ' ASN . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 66' ' ' LYS . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.498 ' CG ' ' HG1' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.498 ' HG1' ' CG ' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.506 ' HG2' HH11 ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HZ3' ' CB ' ' A' ' 108' ' ' LYS . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 113' ' ' LEU . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.541 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.541 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.552 ' O ' ' N ' ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.54 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.8700000000000001 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.552 ' N ' ' O ' ' A' ' 128' ' ' TYR . 20.6 p -101.39 70.64 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.6299999999999999 109.211 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 83.7 m-20 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.723 -0.843 . . . . 6.4800000000000004 108.723 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 109.281 -0.637 . . . . 18.699999999999999 109.281 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p -73.73 157.21 36.92 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.223 -0.923 . . . . 15.970000000000001 109.565 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HZ2' ' CA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.2599999999999998 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.466 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.3 m120 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.466 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CB ' ' O ' ' A' ' 26' ' ' GLY . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.432 ' CE1' ' OG ' ' A' ' 125' ' ' SER . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 37' ' ' GLU . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 47' ' ' ILE . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.597 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.555 ' HZ3' ' CB ' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.548 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.548 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 5.1 p30 -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.526 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.423 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.526 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.531 ' HG2' HH11 ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.42 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.523 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.8700000000000001 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 22.2 p -101.25 67.61 1.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.6299999999999999 110.189 -179.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 41.3 m-20 . . . . . 0 N--CA 1.493 1.725 0 O-C-N 120.998 -1.064 . . . . 6.4800000000000004 108.991 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 109.149 -0.685 . . . . 18.699999999999999 109.149 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p -74.44 159.26 32.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.169 -0.957 . . . . 15.970000000000001 109.353 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' CG2' ' N ' ' A' ' 11' ' ' LYS . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' ' CG2' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.2599999999999998 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.609 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.609 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.43 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 38' ' ' TYR . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.433 ' N ' HD21 ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.526 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.526 ' N ' ' HG ' ' A' ' 48' ' ' SER . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.565 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.408 HD11 HG23 ' A' ' 68' ' ' ILE . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.503 ' NH1' ' CG2' ' A' ' 87' ' ' THR . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.408 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.415 ' HB3' HH22 ' A' ' 88' ' ' ARG . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.565 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 17.6 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.425 ' C ' ' CD1' ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.497 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.485 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.8700000000000001 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 128' ' ' TYR . 17.7 p -107.77 74.79 0.97 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.6299999999999999 109.347 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 59.6 m-80 . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.061 -1.024 . . . . 6.4800000000000004 108.45 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 109.366 -0.605 . . . . 18.699999999999999 109.366 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p -75.74 163.23 27.49 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.235 -0.916 . . . . 15.970000000000001 109.674 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.449 HE22 ' H ' ' A' ' 133' ' ' ASN . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.512 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.537 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.2599999999999998 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.584 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.584 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.487 ' N ' ' O ' ' A' ' 26' ' ' GLY . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.652 HD22 HD22 ' A' ' 82' ' ' ASN . 96.1 m-20 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.58 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.522 ' CD1' ' HZ2' ' A' ' 64' ' ' LYS . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.522 ' HZ2' ' CD1' ' A' ' 55' ' ' ILE . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.42 ' N ' ' O ' ' A' ' 65' ' ' ALA . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.443 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.652 HD22 HD22 ' A' ' 42' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.443 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.541 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.541 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.58 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 43.2 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.537 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.468 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.534 ' O ' ' N ' ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.8700000000000001 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.534 ' N ' ' O ' ' A' ' 128' ' ' TYR . 40.0 p -117.12 83.02 1.91 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.6299999999999999 109.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.449 ' H ' HE22 ' A' ' 7' ' ' GLN . 31.6 m-80 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 108.328 -0.99 . . . . 6.4800000000000004 108.328 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.44 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 40.9 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.17 -0.678 . . . . 18.699999999999999 109.17 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p -75.85 168.54 19.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.32 -0.863 . . . . 15.970000000000001 109.565 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.2599999999999998 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.605 ' HG ' ' ND2' ' A' ' 19' ' ' ASN . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.605 ' ND2' ' HG ' ' A' ' 16' ' ' SER . 91.3 m-20 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.578 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.478 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.578 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.481 ' N ' ' O ' ' A' ' 26' ' ' GLY . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.422 ' O ' ' N ' ' A' ' 37' ' ' GLU . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.513 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.674 HD22 ' ND2' ' A' ' 82' ' ' ASN . 98.5 m-20 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HZ1' ' CD ' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.441 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.441 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.674 ' ND2' HD22 ' A' ' 42' ' ' ASN . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CE2' ' A' ' 103' ' ' PHE . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CE2' ' SG ' ' A' ' 102' ' ' CYS . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.491 ' CD ' ' HZ1' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.486 ' O ' ' OG ' ' A' ' 118' ' ' SER . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HG2' HH11 ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.8700000000000001 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p -103.51 70.4 1.03 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.6299999999999999 108.923 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 6.4800000000000004 108.701 179.95 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 109.275 -0.639 . . . . 18.699999999999999 109.275 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p -71.96 159.43 34.25 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.279 -0.888 . . . . 15.970000000000001 109.365 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.2599999999999998 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.1 m120 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.85 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.85 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.63 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.63 ' N ' ' HG ' ' A' ' 48' ' ' SER . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.466 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.466 ' N ' ' HG ' ' A' ' 59' ' ' SER . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.429 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' N ' ' O ' ' A' ' 65' ' ' ALA . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.442 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.417 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.469 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.469 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' CD2' ' C ' ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.469 ' NH1' ' CB ' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.464 ' HG2' HH11 ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.474 ' O ' ' N ' ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.479 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.8700000000000001 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 128' ' ' TYR . 30.5 p -115.15 81.57 1.6 Allowed 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.6299999999999999 108.649 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 39.2 m-80 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 121.323 -0.861 . . . . 6.4800000000000004 109.136 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.6 t . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.314 0.578 . . . . 18.699999999999999 109.959 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p -77.97 160.99 27.85 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.448 -0.782 . . . . 15.970000000000001 109.196 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.2599999999999998 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.7 m120 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.517 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.409 ' N ' ' O ' ' A' ' 26' ' ' GLY . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.668 HD22 HD22 ' A' ' 82' ' ' ASN . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.642 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.584 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ3' ' CD1' ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.424 HG22 HD13 ' A' ' 68' ' ' ILE . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.404 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.668 HD22 HD22 ' A' ' 42' ' ' ASN . 5.2 p30 -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.418 ' HG2' HH11 ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.642 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.6 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.6 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.8700000000000001 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 9.3 p -104.75 78.82 1.47 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.6299999999999999 108.943 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 . . . . . 0 C--N 1.294 -1.836 0 N-CA-C 107.469 -1.308 . . . . 6.4800000000000004 107.469 179.094 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 107.726 -1.213 . . . . 18.699999999999999 107.726 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p -74.95 160.57 30.41 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.079 -1.013 . . . . 15.970000000000001 110.172 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.2599999999999998 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.423 ' CD1' ' CZ ' ' A' ' 111' ' ' PHE . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.663 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.663 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.528 ' N ' ' O ' ' A' ' 26' ' ' GLY . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 38' ' ' TYR . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.525 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.496 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.667 HD22 HD22 ' A' ' 82' ' ' ASN . 99.2 m-20 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.55 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.411 ' HH ' ' CB ' ' A' ' 102' ' ' CYS . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ1' ' CD1' ' A' ' 68' ' ' ILE . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.447 ' CD1' ' HZ1' ' A' ' 64' ' ' LYS . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.417 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.667 HD22 HD22 ' A' ' 42' ' ' ASN . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.411 ' CB ' ' HH ' ' A' ' 52' ' ' TYR . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.423 ' CZ ' ' CD1' ' A' ' 21' ' ' ILE . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.466 ' HG2' HH11 ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.521 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.8700000000000001 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.521 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p -116.76 80.42 1.47 Allowed 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.6299999999999999 109.348 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.757 -0.831 . . . . 6.4800000000000004 108.757 179.367 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.0 t . . . . . 0 N--CA 1.5 2.043 0 N-CA-C 109.086 -0.709 . . . . 18.699999999999999 109.086 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p -72.91 159.09 34.26 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.465 -0.772 . . . . 15.970000000000001 109.121 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.539 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 15' ' ' GLU . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.52 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.2599999999999998 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 12' ' ' LYS . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.64 ' HD1' ' N ' ' A' ' 25' ' ' CYS . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.64 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.505 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.478 ' N ' ' O ' ' A' ' 26' ' ' GLY . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD1' ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.427 ' SG ' ' OE1' ' A' ' 107' ' ' GLN . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' HZ1' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.488 ' N ' ' O ' ' A' ' 65' ' ' ALA . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.44 ' O ' ' OG ' ' A' ' 74' ' ' SER . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 42' ' ' ASN . 0.1 OUTLIER -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.453 ' O ' ' OG ' ' A' ' 92' ' ' SER . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.422 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.422 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.594 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.594 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.55 ' CG ' ' HZ1' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.427 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.467 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.52 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.697 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.534 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.8700000000000001 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.534 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p -113.63 67.24 0.67 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.6299999999999999 110.427 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.532 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 34.0 m120 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.002 -1.061 . . . . 6.4800000000000004 108.258 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.496 1.826 0 N-CA-C 108.543 -0.91 . . . . 18.699999999999999 108.543 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p -72.17 154.35 41.1 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.952 -1.092 . . . . 15.970000000000001 108.445 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.2599999999999998 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.43 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.43 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.601 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.601 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.443 ' O ' ' OG ' ' A' ' 74' ' ' SER . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.622 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.447 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' OG ' ' A' ' 92' ' ' SER . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.455 ' HG2' HH11 ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.498 ' OD1' ' SG ' ' A' ' 102' ' ' CYS . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.601 ' SD ' ' N ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.498 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.578 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.578 ' N ' ' HG ' ' A' ' 118' ' ' SER . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.406 ' NH1' ' HG2' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.842 ' HE ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.465 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.8700000000000001 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.465 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 16.7 p -106.88 67.88 0.72 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.6299999999999999 109.754 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 20.0 m120 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.17 -1.048 . . . . 6.4800000000000004 108.17 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.56 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 63.0 t . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.276 0.56 . . . . 18.699999999999999 109.938 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p -70.98 153.91 42.26 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.24 -1.022 . . . . 15.970000000000001 108.24 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.489 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.2599999999999998 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 19' ' ' ASN . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.627 ' HG ' ' ND2' ' A' ' 19' ' ' ASN . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.627 ' ND2' ' HG ' ' A' ' 16' ' ' SER . 91.5 m-20 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.562 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.562 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.56 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 26' ' ' GLY . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.474 ' H ' ' HG ' ' A' ' 39' ' ' SER . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.405 HG22 ' N ' ' A' ' 44' ' ' ASP . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.405 ' N ' HG22 ' A' ' 43' ' ' ILE . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.451 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.503 ' SG ' ' OE1' ' A' ' 107' ' ' GLN . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.537 ' HZ1' ' CB ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.434 HD12 HG21 ' A' ' 68' ' ' ILE . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.43 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.422 ' HG1' ' HG3' ' A' ' 109' ' ' LYS . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.439 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.428 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.505 ' HG ' ' N ' ' A' ' 93' ' ' ARG . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.505 ' N ' ' HG ' ' A' ' 92' ' ' SER . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.537 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.503 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.422 ' HG3' ' HG1' ' A' ' 87' ' ' THR . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.489 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.582 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.418 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.8700000000000001 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.582 ' N ' ' O ' ' A' ' 128' ' ' TYR . 6.2 p -118.12 87.42 2.72 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.6299999999999999 108.712 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.418 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 7.6 m120 . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.612 -1.305 . . . . 6.4800000000000004 108.155 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 108.768 -0.827 . . . . 18.699999999999999 108.768 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p -73.99 157.82 35.47 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.197 -0.939 . . . . 15.970000000000001 109.113 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.401 ' CD1' ' N ' ' A' ' 13' ' ' TRP . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.2599999999999998 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.441 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.528 ' N ' ' O ' ' A' ' 26' ' ' GLY . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.401 ' HZ2' ' NE2' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.416 HD13 HG23 ' A' ' 68' ' ' ILE . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.409 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.604 ' HG ' ' H ' ' A' ' 76' ' ' GLN . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.604 ' H ' ' HG ' ' A' ' 74' ' ' SER . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.401 ' NE2' ' HZ2' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.541 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.48 ' N ' ' OG ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.439 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.8700000000000001 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.4 p -109.92 78.3 1.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.6299999999999999 108.561 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 C--N 1.299 -1.617 0 N-CA-C 108.566 -0.902 . . . . 6.4800000000000004 108.566 -179.646 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 121.199 0.523 . . . . 18.699999999999999 109.739 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p -78.44 150.25 33.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.398 -0.814 . . . . 15.970000000000001 109.135 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.2599999999999998 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' CD2' ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.409 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.423 ' N ' ' O ' ' A' ' 26' ' ' GLY . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 38' ' ' TYR . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.555 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.446 ' OE2' ' O ' ' A' ' 74' ' ' SER . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.495 ' N ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.434 ' HG2' HH11 ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.521 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.581 ' ND2' ' HZ3' ' A' ' 116' ' ' LYS . 20.3 m120 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' ' CD2' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.581 ' HZ3' ' ND2' ' A' ' 112' ' ' ASN . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 114' ' ' MET . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.409 ' NH1' ' HG2' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.8700000000000001 108.01 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.617 ' N ' ' O ' ' A' ' 128' ' ' TYR . 4.0 p -117.92 91.88 3.69 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.6299999999999999 107.911 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 . . . . . 0 C--N 1.293 -1.853 0 O-C-N 121.05 -1.031 . . . . 6.4800000000000004 108.708 -179.23 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 109.475 -0.565 . . . . 18.699999999999999 109.475 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p -77.63 160.69 28.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 15.970000000000001 110.042 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.2599999999999998 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.501 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.501 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.0 m-20 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 6.0 m120 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.422 ' N ' ' O ' ' A' ' 26' ' ' GLY . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 38' ' ' TYR . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.57 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.591 ' HZ1' ' NE2' ' A' ' 107' ' ' GLN . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.586 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.432 ' CG2' ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' ' OG ' ' A' ' 92' ' ' SER . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.591 ' NE2' ' HZ1' ' A' ' 53' ' ' LYS . 24.9 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.411 HH11 ' HG3' ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.8700000000000001 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 36.0 p -104.06 56.1 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.6299999999999999 110.946 -178.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 . . . . . 0 N--CA 1.495 1.79 0 O-C-N 120.713 -1.242 . . . . 6.4800000000000004 107.952 178.911 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.496 1.838 0 N-CA-C 109.038 -0.727 . . . . 18.699999999999999 109.038 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p -73.96 160.11 31.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.296 -0.878 . . . . 15.970000000000001 109.923 -179.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.467 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.2599999999999998 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.488 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.68 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.442 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.68 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 26' ' ' GLY . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.528 ' CB ' HD21 ' A' ' 42' ' ' ASN . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.599 HD22 ' ND2' ' A' ' 82' ' ' ASN . 81.7 m-20 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.413 HG22 HD13 ' A' ' 55' ' ' ILE . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 65' ' ' ALA . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.599 ' ND2' HD22 ' A' ' 42' ' ' ASN . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' OG ' ' A' ' 92' ' ' SER . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.402 ' CB ' ' HG ' ' A' ' 102' ' ' CYS . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.402 ' HG ' ' CB ' ' A' ' 94' ' ' ASN . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.55 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.485 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.426 ' O ' ' OG ' ' A' ' 118' ' ' SER . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.541 ' HG ' ' N ' ' A' ' 119' ' ' TYR . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.424 HH11 ' HG3' ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.417 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.437 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.8700000000000001 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 43.3 p -97.69 65.29 1.85 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.6299999999999999 109.313 179.572 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.437 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 97.8 m-20 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 6.4800000000000004 109.115 -179.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 108.448 -0.945 . . . . 18.699999999999999 108.448 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p -77.16 159.34 29.81 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.398 -0.814 . . . . 15.970000000000001 109.512 -179.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.2599999999999998 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.514 ' N ' ' O ' ' A' ' 26' ' ' GLY . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.524 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.408 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.408 ' N ' ' HG ' ' A' ' 59' ' ' SER . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.466 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' OG ' ' A' ' 92' ' ' SER . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.418 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.603 HD21 ' HZ2' ' A' ' 116' ' ' LYS . 18.6 m120 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.603 ' HZ2' HD21 ' A' ' 112' ' ' ASN . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.466 ' HG2' HH11 ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.519 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.8700000000000001 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 128' ' ' TYR . 25.3 p -102.45 62.19 0.85 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.6299999999999999 110.063 -179.23 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 15.7 m120 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.136 -0.977 . . . . 6.4800000000000004 109.195 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.461 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 15.7 t . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 121.419 0.628 . . . . 18.699999999999999 109.596 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p -79.91 170.1 16.95 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.424 -0.798 . . . . 15.970000000000001 109.776 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.2599999999999998 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.461 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 26' ' ' GLY . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.504 HD22 ' ND2' ' A' ' 82' ' ' ASN . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HZ3' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.437 HD11 HG23 ' A' ' 68' ' ' ILE . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.58 ' N ' HD21 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.506 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.506 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.414 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.484 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.531 ' C ' ' HZ3' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.434 ' O ' ' OG ' ' A' ' 118' ' ' SER . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.432 ' H ' ' CD ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.49 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.448 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.8700000000000001 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.49 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 4.5 p -116.85 82.98 1.89 Allowed 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.6299999999999999 108.797 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.528 ' H ' HD21 ' A' ' 133' ' ' ASN . 1.1 m-80 . . . . . 0 C--N 1.295 -1.783 0 O-C-N 120.976 -1.077 . . . . 6.4800000000000004 108.254 -179.554 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 108.557 -0.905 . . . . 18.699999999999999 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p -74.19 156.81 36.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.067 -1.021 . . . . 15.970000000000001 110.087 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' CB ' ' HZ1' ' A' ' 12' ' ' LYS . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.2599999999999998 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.494 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.494 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.3 m-20 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.451 ' O ' ' CD2' ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.732 ' HD1' ' H ' ' A' ' 25' ' ' CYS . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.732 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' TYR . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.556 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.484 ' HG ' ' N ' ' A' ' 60' ' ' LYS . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.484 ' N ' ' HG ' ' A' ' 59' ' ' SER . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.561 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.405 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.625 ' HG1' ' HZ2' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.414 ' O ' ' OG ' ' A' ' 92' ' ' SER . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.556 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.625 ' HZ2' ' HG1' ' A' ' 87' ' ' THR . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.476 ' O ' ' OG ' ' A' ' 118' ' ' SER . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.476 ' OG ' ' O ' ' A' ' 114' ' ' MET . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.578 ' O ' ' N ' ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.8700000000000001 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.578 ' N ' ' O ' ' A' ' 128' ' ' TYR . 4.0 p -119.98 83.27 2.02 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.6299999999999999 108.383 179.159 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.2 m120 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 120.421 -1.425 . . . . 6.4800000000000004 108.566 -179.424 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.498 1.971 0 N-CA-C 109.062 -0.718 . . . . 18.699999999999999 109.062 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p -72.02 157.39 37.89 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.257 -0.902 . . . . 15.970000000000001 109.595 -179.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.489 ' OE1' ' N ' ' A' ' 133' ' ' ASN . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.421 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.436 ' CB ' ' HZ2' ' A' ' 11' ' ' LYS . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.2599999999999998 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.518 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.717 ' HD1' ' N ' ' A' ' 24' ' ' GLU . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.717 ' N ' ' HD1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.502 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' GLY . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' O ' ' N ' ' A' ' 38' ' ' TYR . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.416 HG23 HD11 ' A' ' 47' ' ' ILE . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.468 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 HG21 ' A' ' 68' ' ' ILE . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.498 ' CG ' ' CE ' ' A' ' 95' ' ' MET . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.445 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.597 ' CD1' ' NH1' ' A' ' 88' ' ' ARG . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.5 ' OD1' ' SG ' ' A' ' 102' ' ' CYS . 9.2 m120 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.5 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.438 ' HZ3' HD22 ' A' ' 112' ' ' ASN . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.517 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.438 HD22 ' HZ3' ' A' ' 108' ' ' LYS . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.574 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.574 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.478 ' HG2' HH11 ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.424 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.8700000000000001 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 128' ' ' TYR . 63.9 p -98.03 67.06 1.89 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.6299999999999999 110.293 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.489 ' N ' ' OE1' ' A' ' 7' ' ' GLN . 1.5 m120 . . . . . 0 C--N 1.299 -1.602 0 N-CA-C 107.165 -1.42 . . . . 6.4800000000000004 107.165 178.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.068 -0.716 . . . . 18.699999999999999 109.068 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p -73.11 161.02 31.11 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.108 -0.995 . . . . 15.970000000000001 109.61 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.522 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.2599999999999998 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.68 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.536 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.68 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.433 ' O ' ' N ' ' A' ' 38' ' ' TYR . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.721 ' HE1' HE21 ' A' ' 107' ' ' GLN . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.416 ' CE2' ' CG2' ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.468 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 76' ' ' GLN . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.558 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.721 HE21 ' HE1' ' A' ' 46' ' ' TRP . 56.2 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.57 ' HZ2' ' ND2' ' A' ' 112' ' ' ASN . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.558 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.57 ' ND2' ' HZ2' ' A' ' 108' ' ' LYS . 98.6 m-20 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.57 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.57 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.522 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.476 ' HG2' HH11 ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.465 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.468 ' NH1' ' CB ' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.559 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.8700000000000001 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.559 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p -117.57 95.29 4.88 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.6299999999999999 106.64 177.621 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 . . . . . 0 C--N 1.289 -2.059 0 C-N-CA 119.894 -0.722 . . . . 6.4800000000000004 109.48 -178.202 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.407 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 35.5 t . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 121.11 0.481 . . . . 18.699999999999999 109.841 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p -76.31 158.65 31.3 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 15.970000000000001 108.815 179.267 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.2599999999999998 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.523 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 97.9 m-20 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 38' ' ' TYR . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.568 HD22 HD22 ' A' ' 82' ' ' ASN . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.626 ' NZ ' ' NE2' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.613 ' CB ' ' HZ3' ' A' ' 60' ' ' LYS . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.613 ' HZ3' ' CB ' ' A' ' 57' ' ' SER . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.417 HD11 HG21 ' A' ' 68' ' ' ILE . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.568 HD22 HD22 ' A' ' 42' ' ' ASN . 7.3 p30 -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.49 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.45 ' O ' ' OG ' ' A' ' 92' ' ' SER . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.498 ' N ' ' CD1' ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 52.5 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.49 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.413 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.462 ' CD2' ' ND2' ' A' ' 82' ' ' ASN . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 114' ' ' MET . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.535 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.419 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.8700000000000001 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.535 ' N ' ' O ' ' A' ' 128' ' ' TYR . 18.8 p -112.4 69.92 0.7 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.6299999999999999 109.685 -179.391 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 12.8 m120 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 120.949 -1.094 . . . . 6.4800000000000004 108.539 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.389 0.614 . . . . 18.699999999999999 109.696 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p -77.09 161.16 28.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 15.970000000000001 109.358 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.2599999999999998 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.42 HD13 HG22 ' A' ' 21' ' ' ILE . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.467 ' N ' ' O ' ' A' ' 26' ' ' GLY . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 38' ' ' TYR . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.432 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.411 HD11 HG23 ' A' ' 55' ' ' ILE . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.507 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.437 ' O ' ' OG ' ' A' ' 92' ' ' SER . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.432 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.507 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.533 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.625 ' NH2' ' HZ1' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.463 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HZ1' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.524 ' CE1' ' OG1' ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.8700000000000001 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.524 ' OG1' ' CE1' ' A' ' 128' ' ' TYR . 11.5 p -110.56 72.93 0.8 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.6299999999999999 110.332 -179.302 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.509 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 74.3 m-80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 107.182 -1.414 . . . . 6.4800000000000004 107.182 178.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.544 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 74.4 t . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 121.637 0.732 . . . . 18.699999999999999 109.922 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p -78.14 152.47 32.75 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.852 -0.53 . . . . 15.970000000000001 109.629 179.654 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.2599999999999998 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.437 ' N ' HD21 ' A' ' 22' ' ' ASN . 2.3 m120 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.748 ' HD1' ' H ' ' A' ' 24' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.748 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.514 ' N ' ' O ' ' A' ' 26' ' ' GLY . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.457 ' N ' ' O ' ' A' ' 29' ' ' ALA . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 38' ' ' TYR . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.499 ' N ' ' CD ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.436 HG22 HD11 ' A' ' 55' ' ' ILE . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.416 HG23 HD12 ' A' ' 68' ' ' ILE . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.47 ' O ' ' OG ' ' A' ' 74' ' ' SER . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.484 ' HG ' ' N ' ' A' ' 77' ' ' ALA . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.484 ' N ' ' HG ' ' A' ' 74' ' ' SER . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.633 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.633 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.502 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.502 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.509 ' HZ3' ' CB ' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.446 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.562 ' O ' ' N ' ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.52 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.8700000000000001 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.562 ' N ' ' O ' ' A' ' 128' ' ' TYR . 5.6 p -115.57 81.86 1.66 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.6299999999999999 108.213 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 28.8 m-80 . . . . . 0 C--N 1.292 -1.927 0 O-C-N 120.868 -1.145 . . . . 6.4800000000000004 108.031 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 109.204 -0.665 . . . . 18.699999999999999 109.204 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.448 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p -77.0 162.96 27.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 15.970000000000001 110.098 -179.714 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.556 ' HZ3' ' CB ' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.2599999999999998 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.41 ' N ' ' O ' ' A' ' 26' ' ' GLY . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.708 HD22 HD22 ' A' ' 82' ' ' ASN . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.52 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.609 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.455 ' HG ' ' N ' ' A' ' 49' ' ' CYS . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.52 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.708 HD22 HD22 ' A' ' 42' ' ' ASN . 5.5 p30 -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.549 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH1' ' CB ' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.609 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 34.3 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.565 HH21 ' HZ1' ' A' ' 124' ' ' LYS . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.565 ' HZ1' HH21 ' A' ' 120' ' ' ARG . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.8700000000000001 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 128' ' ' TYR . 30.2 p -107.94 72.46 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.6299999999999999 109.31 -179.763 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 130' ' ' ASP . 28.2 m120 . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 108.461 -0.94 . . . . 6.4800000000000004 108.461 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.196 -0.668 . . . . 15.97 109.196 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' N ' ' A' ' 11' ' ' LYS . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.452 ' N ' HG23 ' A' ' 10' ' ' VAL . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.26 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.925 HD11 ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.656 ' O ' HD21 ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HA ' HD11 ' A' ' 100' ' ' ILE . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE1' HG21 ' A' ' 73' ' ' ILE . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 75' ' ' VAL . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.478 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.478 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.489 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.432 ' HG3' HH11 ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.475 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.657 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.925 ' SD ' HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.648 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.516 HH11 ' HG2' ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.552 ' CZ ' HG21 ' A' ' 132' ' ' THR . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.87 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.552 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 27.5 p . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.63 109.516 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 121.227 0.537 . . . . 15.97 109.633 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.875 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.662 HG21 HG22 ' A' ' 132' ' ' THR . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.26 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.934 HD23 ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.583 ' O ' HD21 ' A' ' 27' ' ' LEU . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.875 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 21' ' ' ILE . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.556 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.665 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HA ' HD13 ' A' ' 100' ' ' ILE . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.665 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.517 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.517 HG21 ' CE2' ' A' ' 69' ' ' TYR . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 81' ' ' VAL . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.483 HH11 ' HG2' ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 56' ' ' LYS . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.934 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.55 ' HB2' HD22 ' A' ' 17' ' ' LEU . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.548 HH11 ' HG2' ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.87 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 128' ' ' TYR . 6.8 p . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.63 109.44 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.0 p . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 121.491 0.662 . . . . 15.97 109.97 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.427 ' HG3' ' HE2' ' A' ' 23' ' ' HIS . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 131' ' ' LEU . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.26 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.844 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.427 ' HE2' ' HG3' ' A' ' 9' ' ' GLU . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.435 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.63 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.506 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' A' ' 64' ' ' LYS . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.689 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.4 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.442 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 17.4 p30 -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.527 HD12 ' NH1' ' A' ' 88' ' ' ARG . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.535 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.575 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.575 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.506 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.454 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.535 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.844 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.584 ' SD ' HD21 ' A' ' 17' ' ' LEU . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 17' ' ' LEU . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.495 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.688 ' CZ ' HG21 ' A' ' 132' ' ' THR . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 10' ' ' VAL . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.87 109.078 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.688 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 82.0 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.63 110.004 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 108.845 -0.798 . . . . 15.97 108.845 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.405 HG21 ' CG2' ' A' ' 132' ' ' THR . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.26 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.742 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.414 ' NZ ' ' CB ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' A' ' 30' ' ' PHE . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.424 ' HA ' HD21 ' A' ' 42' ' ' ASN . 9.4 m120 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.441 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.441 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 81' ' ' VAL . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.541 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.571 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.571 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.541 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.545 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.519 ' SD ' HD21 ' A' ' 17' ' ' LEU . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.495 HH11 ' HG2' ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.418 ' O ' ' OG1' ' A' ' 132' ' ' THR . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 126' ' ' ARG . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.87 108.697 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 80.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.63 108.122 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 109.49 -0.559 . . . . 15.97 109.49 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 132' ' ' THR . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' HG23 ' A' ' 10' ' ' VAL . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.26 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.5 HD21 ' SD ' ' A' ' 114' ' ' MET . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.792 ' CE2' HD11 ' A' ' 34' ' ' LEU . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.478 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.792 HD11 ' CE2' ' A' ' 30' ' ' PHE . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.508 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.618 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.559 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.664 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.664 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.475 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.475 HG21 ' CE1' ' A' ' 69' ' ' TYR . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.443 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.417 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.527 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 100' ' ' ILE . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.527 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.442 ' HG3' HH11 ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.87 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.63 109.743 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.492 1.625 0 N-CA-C 109.243 -0.651 . . . . 15.97 109.243 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.568 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.854 HG21 HG22 ' A' ' 132' ' ' THR . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.48 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.26 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.502 HD23 ' CD2' ' A' ' 111' ' ' PHE . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.457 ' O ' HD21 ' A' ' 27' ' ' LEU . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.568 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 21' ' ' ILE . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' A' ' 34' ' ' LEU . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.813 HD11 ' CE2' ' A' ' 30' ' ' PHE . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.533 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.578 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.404 HG23 ' N ' ' A' ' 44' ' ' ASP . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 43' ' ' ILE . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.542 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.488 ' NZ ' ' CB ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.566 ' O ' ' ND2' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.522 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 66' ' ' LYS . 70.9 m-80 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.522 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.502 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.404 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 119' ' ' TYR . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 122' ' ' PHE . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.48 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.667 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.87 109.792 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.854 HG22 HG21 ' A' ' 10' ' ' VAL . 64.1 p . . . . . 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.63 110.145 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 121.428 0.633 . . . . 15.97 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 HG22 ' A' ' 132' ' ' THR . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.26 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.475 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.407 ' O ' HD21 ' A' ' 27' ' ' LEU . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 52.7 m-20 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.532 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.532 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.407 HD21 ' O ' ' A' ' 21' ' ' ILE . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.613 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.613 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.402 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' HG21 ' A' ' 73' ' ' ILE . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.418 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.411 ' N ' ' OD2' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.552 HH11 ' HG2' ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.511 ' HA ' ' HZ3' ' A' ' 108' ' ' LYS . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.511 ' HZ3' ' HA ' ' A' ' 105' ' ' GLU . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.623 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.428 ' SD ' HD21 ' A' ' 17' ' ' LEU . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.545 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.744 ' CE1' HG21 ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.87 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.744 HG21 ' CE1' ' A' ' 128' ' ' TYR . 20.6 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.63 109.211 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 121.295 0.569 . . . . 15.97 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.8 HG21 HG22 ' A' ' 132' ' ' THR . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.26 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' CD2' ' A' ' 111' ' ' PHE . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.676 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 18' ' ' GLU . 62.4 m-20 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD21 ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.52 ' HE1' HD13 ' A' ' 43' ' ' ILE . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 30' ' ' PHE . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.405 ' HZ1' ' HB2' ' A' ' 107' ' ' GLN . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.542 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.597 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.542 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 0.3 OUTLIER -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.409 ' HA ' HH22 ' A' ' 88' ' ' ARG . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.437 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 96' ' ' LEU . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.627 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.577 HH11 ' HG2' ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.771 ' CZ ' HG21 ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.87 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.8 HG22 HG21 ' A' ' 10' ' ' VAL . 22.2 p . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.63 110.189 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.353 -0.61 . . . . 15.97 109.353 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 132' ' ' THR . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.26 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 111' ' ' PHE . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.491 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.469 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 30' ' ' PHE . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.456 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.472 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 81' ' ' VAL . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.565 HD13 ' NH1' ' A' ' 88' ' ' ARG . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.565 ' NH1' HD13 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.513 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.493 ' HG3' HD22 ' A' ' 17' ' ' LEU . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.87 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 17.7 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.63 109.347 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.361 0.601 . . . . 15.97 109.674 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.681 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.749 HG21 HG22 ' A' ' 132' ' ' THR . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.47 ' CD1' ' N ' ' A' ' 13' ' ' TRP . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.26 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 111' ' ' PHE . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.419 ' O ' HD21 ' A' ' 27' ' ' LEU . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.681 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.689 ' CE2' HD11 ' A' ' 34' ' ' LEU . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.689 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.419 ' ND2' HD12 ' A' ' 110' ' ' ILE . 10.7 m120 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.488 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.639 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.639 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.426 HG22 ' H ' ' A' ' 81' ' ' VAL . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.445 HH12 HD13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.503 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.503 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.488 ' CD ' ' NZ ' ' A' ' 53' ' ' LYS . 7.9 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.419 HD12 ' ND2' ' A' ' 42' ' ' ASN . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.514 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.46 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.924 ' CZ ' HG21 ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.87 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.924 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 40.0 p . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.63 109.183 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.565 -0.531 . . . . 15.97 109.565 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.655 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.26 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.489 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.566 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.408 HD21 ' HA ' ' A' ' 19' ' ' ASN . 9.8 m120 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.465 ' O ' HD21 ' A' ' 27' ' ' LEU . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.655 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.826 ' CE2' HD11 ' A' ' 34' ' ' LEU . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.826 HD11 ' CE2' ' A' ' 30' ' ' PHE . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.435 ' O ' ' OG ' ' A' ' 39' ' ' SER . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.442 ' CD ' ' OE1' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.57 ' CE2' HG21 ' A' ' 73' ' ' ILE . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.604 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.57 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.408 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.604 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.442 ' OE1' ' CD ' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.566 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.491 ' SD ' HD21 ' A' ' 17' ' ' LEU . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.436 HH11 ' HG2' ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.87 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.63 108.923 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 121.445 0.641 . . . . 15.97 109.365 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.682 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.77 HG21 HG22 ' A' ' 132' ' ' THR . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.26 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' CD2' ' A' ' 111' ' ' PHE . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 67.1 m-20 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.682 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.716 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.553 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.687 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.496 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.441 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.441 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.541 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.661 ' C ' HD23 ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.469 ' CB ' ' NH1' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.496 HH11 ' HG2' ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.816 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.87 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.816 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.5 p . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.63 108.649 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 109.196 -0.668 . . . . 15.97 109.196 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 10' ' ' VAL . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.571 HG21 HG23 ' A' ' 132' ' ' THR . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.26 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.557 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.486 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 69.2 m-20 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 23' ' ' HIS . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.486 HD21 ' O ' ' A' ' 21' ' ' ILE . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.82 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.82 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.546 HD13 ' HE2' ' A' ' 30' ' ' PHE . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.676 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.42 ' NZ ' HD11 ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 ' NZ ' ' A' ' 64' ' ' LYS . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.403 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.555 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.592 ' ND2' ' CD1' ' A' ' 110' ' ' ILE . 0.4 OUTLIER -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.676 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.592 ' CD1' ' ND2' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.557 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.415 HH11 ' HG2' ' A' ' 120' ' ' ARG . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.87 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.571 HG23 HG21 ' A' ' 10' ' ' VAL . 9.3 p . . . . . 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.63 108.943 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.52 0.676 . . . . 15.97 110.172 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.457 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.26 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.81 HD23 ' CD2' ' A' ' 111' ' ' PHE . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.456 ' O ' HD21 ' A' ' 27' ' ' LEU . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.474 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 21' ' ' ILE . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.776 ' CE2' HD11 ' A' ' 34' ' ' LEU . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.776 HD11 ' CE2' ' A' ' 30' ' ' PHE . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.488 ' O ' ' OG ' ' A' ' 39' ' ' SER . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.421 ' ND2' HD12 ' A' ' 110' ' ' ILE . 8.5 m120 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CE2' HG21 ' A' ' 73' ' ' ILE . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.429 ' H ' HG22 ' A' ' 75' ' ' VAL . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.421 HD12 ' ND2' ' A' ' 42' ' ' ASN . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.81 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.5 HH11 ' HG2' ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.516 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.87 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.516 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.63 109.348 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.121 -0.696 . . . . 15.97 109.121 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.861 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.26 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.861 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.447 ' HG ' ' HE2' ' A' ' 53' ' ' LYS . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.547 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.547 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.605 ' H ' HD21 ' A' ' 42' ' ' ASN . 11.1 p30 -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.466 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.44 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.44 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.623 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.424 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.466 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.478 HD22 ' ND2' ' A' ' 82' ' ' ASN . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.505 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.765 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.479 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.87 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.479 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p . . . . . 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.63 110.427 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.445 -0.946 . . . . 15.97 108.445 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.446 HG23 ' N ' ' A' ' 11' ' ' LYS . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.446 ' N ' HG23 ' A' ' 10' ' ' VAL . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.26 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 111' ' ' PHE . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.407 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.854 ' CE2' HD11 ' A' ' 34' ' ' LEU . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.854 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.597 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.597 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.412 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 5.5 p30 -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.416 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.481 HH11 ' HG2' ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 98' ' ' PRO . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 49' ' ' CYS . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.441 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.567 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.423 ' HG2' ' NH1' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.827 ' H ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.462 ' O ' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.87 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 16.7 p . . . . . 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.63 109.754 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.24 -1.022 . . . . 15.97 108.24 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.64 HG21 HG22 ' A' ' 132' ' ' THR . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.406 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.26 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.425 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.4 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.562 ' O ' HD21 ' A' ' 27' ' ' LEU . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 21' ' ' ILE . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 34' ' ' LEU . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 30' ' ' PHE . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' O ' HG22 ' A' ' 43' ' ' ILE . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.613 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.613 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 75' ' ' VAL . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.401 ' ND2' HD23 ' A' ' 113' ' ' LEU . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 83' ' ' LEU . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.478 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.409 HD13 ' HA ' ' A' ' 110' ' ' ILE . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.401 HD23 ' ND2' ' A' ' 82' ' ' ASN . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.425 ' OH ' ' C ' ' A' ' 16' ' ' SER . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.515 ' CD2' ' OG1' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.87 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.64 HG22 HG21 ' A' ' 10' ' ' VAL . 6.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.63 108.712 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.113 -0.699 . . . . 15.97 109.113 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.701 HG21 HG22 ' A' ' 132' ' ' THR . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.521 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.26 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.785 HD12 ' CE1' ' A' ' 119' ' ' TYR . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.694 ' CD2' HD11 ' A' ' 34' ' ' LEU . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HA ' HD12 ' A' ' 34' ' ' LEU . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.694 HD11 ' CD2' ' A' ' 30' ' ' PHE . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.433 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.615 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.526 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.559 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.526 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.44 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.442 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.625 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.48 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.48 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.785 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 121' ' ' ARG . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.434 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.514 HH11 ' HG2' ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.87 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.4 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.63 108.561 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.135 -0.691 . . . . 15.97 109.135 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 81.8 mm-40 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.672 ' HG2' ' HE2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.649 HG21 HG22 ' A' ' 132' ' ' THR . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.26 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.9 HD21 ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.483 ' O ' HD21 ' A' ' 27' ' ' LEU . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 9' ' ' GLU . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.483 HD21 ' O ' ' A' ' 21' ' ' ILE . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.852 ' CE2' HD11 ' A' ' 34' ' ' LEU . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.852 HD11 ' CE2' ' A' ' 30' ' ' PHE . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.408 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.519 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.442 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.408 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.467 ' HB3' ' OE2' ' A' ' 80' ' ' GLU . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.467 ' OE2' ' HB3' ' A' ' 77' ' ' ALA . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.441 HD22 HD21 ' A' ' 113' ' ' LEU . 5.4 p30 -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.451 ' HG1' ' HE3' ' A' ' 109' ' ' LYS . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.401 HG21 ' CE2' ' A' ' 103' ' ' PHE . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.462 HH11 ' HG2' ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 91' ' ' THR . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.406 ' HA ' ' HZ1' ' A' ' 53' ' ' LYS . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.519 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HE3' ' HG1' ' A' ' 87' ' ' THR . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.873 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.441 HD21 HD22 ' A' ' 82' ' ' ASN . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.9 ' SD ' HD21 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB2' HD22 ' A' ' 17' ' ' LEU . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.422 ' HG3' HH11 ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.415 ' HG2' ' NH1' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.735 ' CE1' HG21 ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.446 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.87 108.01 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.735 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.63 107.911 179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.706 0.765 . . . . 15.97 110.042 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.26 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.438 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 111' ' ' PHE . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 83.7 m-20 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.533 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 34' ' ' LEU . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.587 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.509 HD21 HG23 ' A' ' 110' ' ' ILE . 3.8 m120 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.457 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.457 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ3' ' HA ' ' A' ' 52' ' ' TYR . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.634 ' CE2' HG21 ' A' ' 73' ' ' ILE . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.509 HG23 HD21 ' A' ' 42' ' ' ASN . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.503 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.46 ' SD ' HD21 ' A' ' 17' ' ' LEU . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.486 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.87 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.486 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 36.0 p . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.63 110.946 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.247 0.546 . . . . 15.97 109.923 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.728 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.684 HG21 HG22 ' A' ' 132' ' ' THR . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.26 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.654 ' O ' HD21 ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.728 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.654 HD21 ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.687 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.687 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.465 ' O ' ' OG ' ' A' ' 39' ' ' SER . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 73' ' ' ILE . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.509 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 53' ' ' LYS . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.554 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.509 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.528 HG22 ' SD ' ' A' ' 114' ' ' MET . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.528 ' SD ' HG22 ' A' ' 110' ' ' ILE . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' PHE . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' HH11 ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.835 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.87 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.835 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 43.3 p . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.63 109.313 179.572 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.395 0.617 . . . . 15.97 109.512 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.642 HG21 HG22 ' A' ' 132' ' ' THR . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.26 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.509 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.429 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.945 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.945 HD11 ' CE2' ' A' ' 30' ' ' PHE . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 43' ' ' ILE . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 40' ' ' GLU . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 49' ' ' CYS . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' A' ' 88' ' ' ARG . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.404 HH21 ' CG ' ' A' ' 90' ' ' GLU . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.509 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.418 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 116' ' ' LYS . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.506 HH11 ' HG2' ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.409 HD23 ' CE1' ' A' ' 128' ' ' TYR . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.817 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.87 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.817 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 25.3 p . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.63 110.063 -179.23 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.35 0.595 . . . . 15.97 109.776 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.591 HG21 HG22 ' A' ' 132' ' ' THR . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.26 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.837 ' CE2' HD11 ' A' ' 34' ' ' LEU . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.837 HD11 ' CE2' ' A' ' 30' ' ' PHE . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.614 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.568 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.568 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.4 HD21 HD11 ' A' ' 110' ' ' ILE . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.504 ' OD2' ' SG ' ' A' ' 86' ' ' CYS . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.501 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.426 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.614 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 HD21 ' A' ' 83' ' ' LEU . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.512 ' CD ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.506 ' CZ ' HG21 ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.87 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.591 HG22 HG21 ' A' ' 10' ' ' VAL . 4.5 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.63 108.797 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.648 0.737 . . . . 15.97 110.087 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.548 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 HG22 ' A' ' 132' ' ' THR . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.26 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.579 HD23 ' CD2' ' A' ' 111' ' ' PHE . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.605 ' O ' HD21 ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.548 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.605 HD21 ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.8 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 30' ' ' PHE . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.663 ' CE2' HG21 ' A' ' 73' ' ' ILE . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.663 HG21 ' CE2' ' A' ' 69' ' ' TYR . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.514 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.48 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.425 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.425 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.436 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.514 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.545 HG22 ' SD ' ' A' ' 114' ' ' MET . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.579 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 110' ' ' ILE . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 122' ' ' PHE . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.87 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.63 108.383 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 121.361 0.601 . . . . 15.97 109.595 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.688 HG21 HG22 ' A' ' 132' ' ' THR . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' HG23 ' A' ' 10' ' ' VAL . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.26 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.518 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.537 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.565 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.496 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.565 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CE2' HD11 ' A' ' 34' ' ' LEU . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD11 ' CE2' ' A' ' 30' ' ' PHE . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.616 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.721 ' CE2' HG21 ' A' ' 73' ' ' ILE . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.444 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.581 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.721 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.581 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.538 HD12 ' NH1' ' A' ' 88' ' ' ARG . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.513 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.65 ' ND2' ' SG ' ' A' ' 102' ' ' CYS . 83.3 m-20 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.65 ' SG ' ' ND2' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.513 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.515 HH11 ' HG2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.899 ' CZ ' HG21 ' A' ' 132' ' ' THR . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.87 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.899 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 63.9 p . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.63 110.293 -179.341 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.363 0.601 . . . . 15.97 109.61 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.471 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.26 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.776 HD23 ' CD2' ' A' ' 111' ' ' PHE . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.491 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.525 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.503 HD21 ' CE2' ' A' ' 30' ' ' PHE . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.517 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.461 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.43 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.47 HG21 ' CE2' ' A' ' 69' ' ' TYR . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.452 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.435 ' N ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.5 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.663 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 99' ' ' THR . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.418 HG23 ' O ' ' A' ' 97' ' ' GLU . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.5 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.776 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.583 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.506 ' HG3' HD22 ' A' ' 17' ' ' LEU . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.471 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.508 HH11 ' HG2' ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.468 ' CB ' ' NH1' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.557 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.87 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.557 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.63 106.64 177.621 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 108.815 -0.809 . . . . 15.97 108.815 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.608 HG21 HG22 ' A' ' 132' ' ' THR . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.26 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.671 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.664 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 ' CE2' ' A' ' 30' ' ' PHE . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HZ3' ' CD ' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.538 ' O ' HD13 ' A' ' 100' ' ' ILE . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 73' ' ' ILE . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 73' ' ' ILE . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.558 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.4 OUTLIER -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.406 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.538 HD13 ' O ' ' A' ' 55' ' ' ILE . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.702 ' CD ' ' HZ3' ' A' ' 53' ' ' LYS . 15.0 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.431 ' NZ ' ' CG ' ' A' ' 84' ' ' ASP . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.671 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.529 ' O ' ' N ' ' A' ' 122' ' ' PHE . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.4 ' CA ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.87 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.608 HG22 HG21 ' A' ' 10' ' ' VAL . 18.8 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.63 109.685 -179.391 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.358 -0.608 . . . . 15.97 109.358 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG21 HG22 ' A' ' 132' ' ' THR . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 12' ' ' LYS . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 23' ' ' HIS . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.26 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 11' ' ' LYS . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.629 HD23 ' CD2' ' A' ' 111' ' ' PHE . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CB ' ' HE1' ' A' ' 13' ' ' TRP . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.682 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.682 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.455 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' HA ' HD13 ' A' ' 34' ' ' LEU . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.597 ' ND2' HD12 ' A' ' 110' ' ' ILE . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HA ' ' A' ' 43' ' ' ILE . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.401 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.552 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.536 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.597 HD12 ' ND2' ' A' ' 42' ' ' ASN . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.629 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.439 ' HG3' HD22 ' A' ' 17' ' ' LEU . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.437 ' OH ' ' C ' ' A' ' 16' ' ' SER . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.619 ' NH2' ' NZ ' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.404 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.619 ' NZ ' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.843 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.87 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.843 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 11.5 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.63 110.332 -179.302 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.179 0.514 . . . . 15.97 109.629 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.617 HG21 HG22 ' A' ' 132' ' ' THR . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.26 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.803 HD23 ' CD2' ' A' ' 111' ' ' PHE . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 18' ' ' GLU . 29.0 m-20 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OE2' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 34' ' ' LEU . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.734 HD11 ' CE2' ' A' ' 30' ' ' PHE . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 ' CE1' ' A' ' 69' ' ' TYR . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 75' ' ' VAL . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.644 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.644 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.508 ' HZ3' ' HB3' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.457 HG22 ' SD ' ' A' ' 114' ' ' MET . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.803 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' HG22 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.472 ' HB2' HD22 ' A' ' 17' ' ' LEU . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.437 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.5 ' N ' ' CD ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.76 ' CE1' HG21 ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.87 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.76 HG21 ' CE1' ' A' ' 128' ' ' TYR . 5.6 p . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.63 108.213 179.637 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.435 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.474 0.654 . . . . 15.97 110.098 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.435 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.598 HG21 HG22 ' A' ' 132' ' ' THR . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.598 ' CB ' ' HZ3' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.26 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 27' ' ' LEU . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 21' ' ' ILE . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.669 ' CE2' HD11 ' A' ' 34' ' ' LEU . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HA ' HD12 ' A' ' 34' ' ' LEU . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.669 HD11 ' CE2' ' A' ' 30' ' ' PHE . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.487 ' OG ' HD23 ' A' ' 34' ' ' LEU . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' A' ' 34' ' ' LEU . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.519 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG21 ' CE2' ' A' ' 69' ' ' TYR . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.55 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.55 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.475 ' CB ' ' NH1' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.514 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.459 ' HG3' HH11 ' A' ' 120' ' ' ARG . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.495 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 128' ' ' TYR . . . . . 0.711 ' CZ ' HG21 ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.87 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.711 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.2 p . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.63 109.31 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 58.4 t . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.061 -0.718 . . . . 18.7 109.061 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p -72.9 159.89 33.01 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.195 -0.941 . . . . 15.97 109.196 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' N ' ' A' ' 11' ' ' LYS . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.452 ' N ' HG23 ' A' ' 10' ' ' VAL . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.26 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.925 HD11 ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.656 ' O ' HD21 ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HA ' HD11 ' A' ' 100' ' ' ILE . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE1' HG21 ' A' ' 73' ' ' ILE . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 75' ' ' VAL . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.478 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.478 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.489 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.432 ' HG3' HH11 ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.475 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.657 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.925 ' SD ' HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.648 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.516 HH11 ' HG2' ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.552 ' CZ ' HG21 ' A' ' 132' ' ' THR . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.87 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.552 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 27.5 p -110.11 79.74 1.24 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.63 109.516 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.45 -0.944 . . . . 6.48 108.45 179.684 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.24 -0.652 . . . . 18.7 109.24 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p -74.4 150.33 40.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.176 -0.952 . . . . 15.97 109.633 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.875 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.662 HG21 HG22 ' A' ' 132' ' ' THR . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.26 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.934 HD23 ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.583 ' O ' HD21 ' A' ' 27' ' ' LEU . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.875 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 21' ' ' ILE . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.556 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.665 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HA ' HD13 ' A' ' 100' ' ' ILE . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.665 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.517 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.517 HG21 ' CE2' ' A' ' 69' ' ' TYR . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 81' ' ' VAL . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.483 HH11 ' HG2' ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 56' ' ' LYS . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.934 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.55 ' HB2' HD22 ' A' ' 17' ' ' LEU . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.548 HH11 ' HG2' ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.87 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 128' ' ' TYR . 6.8 p -103.22 74.23 1.27 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.63 109.44 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m120 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.504 -0.924 . . . . 6.48 108.504 -179.902 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.499 HG12 HD22 ' A' ' 131' ' ' LEU . 7.5 p . . . . . 0 N--CA 1.498 1.94 0 CA-C-O 121.278 0.561 . . . . 18.7 109.861 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.0 p -75.69 159.18 31.4 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.344 -0.847 . . . . 15.97 109.97 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 133' ' ' ASN . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.427 ' HG3' ' HE2' ' A' ' 23' ' ' HIS . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 131' ' ' LEU . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.26 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.844 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.427 ' HE2' ' HG3' ' A' ' 9' ' ' GLU . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.435 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.506 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' A' ' 64' ' ' LYS . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.689 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.4 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.442 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 17.4 p30 -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.527 HD12 ' NH1' ' A' ' 88' ' ' ARG . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.535 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.575 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.506 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.454 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.535 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.844 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.584 ' SD ' HD21 ' A' ' 17' ' ' LEU . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 17' ' ' LEU . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.495 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.688 ' CZ ' HG21 ' A' ' 132' ' ' THR . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.499 HD22 HG12 ' A' ' 5' ' ' VAL . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.87 109.078 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.688 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 82.0 p -97.29 63.35 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.63 110.004 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.418 ' HB2' HE21 ' A' ' 7' ' ' GLN . 61.5 m-20 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 107.863 -1.162 . . . . 6.48 107.863 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.464 ' HB ' HD22 ' A' ' 131' ' ' LEU . 58.5 t . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 121.347 0.594 . . . . 18.7 109.636 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -72.07 159.94 33.31 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.4 -0.813 . . . . 15.97 108.845 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.405 HG21 ' CG2' ' A' ' 132' ' ' THR . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.26 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.742 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.414 ' NZ ' ' CB ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' A' ' 30' ' ' PHE . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.424 ' HA ' HD21 ' A' ' 42' ' ' ASN . 9.4 m120 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.441 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.441 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 81' ' ' VAL . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.541 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.571 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.571 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.541 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.545 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.519 ' SD ' HD21 ' A' ' 17' ' ' LEU . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.495 HH11 ' HG2' ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.418 ' O ' ' OG1' ' A' ' 132' ' ' THR . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.506 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.464 HD22 ' HB ' ' A' ' 5' ' ' VAL . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.87 108.697 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 80.4 p -110.93 80.91 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.63 108.122 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.506 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 5.5 m120 . . . . . 0 C--N 1.295 -1.782 0 C-N-CA 119.603 -0.839 . . . . 6.48 109.357 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 108.591 -0.892 . . . . 18.7 108.591 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p -72.13 141.58 49.15 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.112 -0.993 . . . . 15.97 109.49 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 132' ' ' THR . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' HG23 ' A' ' 10' ' ' VAL . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.26 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.5 HD21 ' SD ' ' A' ' 114' ' ' MET . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.792 ' CE2' HD11 ' A' ' 34' ' ' LEU . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.478 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.792 HD11 ' CE2' ' A' ' 30' ' ' PHE . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.508 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.618 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.559 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.664 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.664 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.475 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.475 HG21 ' CE1' ' A' ' 69' ' ' TYR . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.443 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.417 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.527 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 100' ' ' ILE . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.527 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.442 ' HG3' HH11 ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.87 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p -113.17 80.66 1.38 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.63 109.743 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 . . . . . 0 C--N 1.294 -1.816 0 O-C-N 120.819 -1.176 . . . . 6.48 107.954 179.509 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' SG ' ' A' ' 25' ' ' CYS . 52.9 t . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.223 -0.658 . . . . 18.7 109.223 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p -73.46 157.14 37.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.164 -0.96 . . . . 15.97 109.243 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 133' ' ' ASN . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.568 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.854 HG21 HG22 ' A' ' 132' ' ' THR . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.48 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.26 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.502 HD23 ' CD2' ' A' ' 111' ' ' PHE . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.457 ' O ' HD21 ' A' ' 27' ' ' LEU . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.568 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.431 ' SG ' HG22 ' A' ' 5' ' ' VAL . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 21' ' ' ILE . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' A' ' 34' ' ' LEU . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.813 HD11 ' CE2' ' A' ' 30' ' ' PHE . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.533 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.578 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.404 HG23 ' N ' ' A' ' 44' ' ' ASP . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 43' ' ' ILE . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.542 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.488 ' NZ ' ' CB ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.566 ' O ' ' ND2' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.522 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 66' ' ' LYS . 70.9 m-80 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.522 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.648 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.502 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.404 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 119' ' ' TYR . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 122' ' ' PHE . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.48 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.667 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.405 HD22 ' HB ' ' A' ' 5' ' ' VAL . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.87 109.792 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.854 HG22 HG21 ' A' ' 10' ' ' VAL . 64.1 p -94.36 61.05 2.76 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.63 110.145 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 32.3 m-20 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.392 -0.817 . . . . 6.48 108.852 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.498 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 34.0 t . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 108.49 -0.93 . . . . 18.7 108.49 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p -71.38 160.26 33.08 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.356 -0.84 . . . . 15.97 109.566 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 HG22 ' A' ' 132' ' ' THR . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.26 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.475 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.407 ' O ' HD21 ' A' ' 27' ' ' LEU . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 52.7 m-20 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.532 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.498 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.532 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.407 HD21 ' O ' ' A' ' 21' ' ' ILE . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.613 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.613 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.402 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' HG21 ' A' ' 73' ' ' ILE . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.418 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.411 ' N ' ' OD2' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.552 HH11 ' HG2' ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.511 ' HA ' ' HZ3' ' A' ' 108' ' ' LYS . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.511 ' HZ3' ' HA ' ' A' ' 105' ' ' GLU . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.623 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.428 ' SD ' HD21 ' A' ' 17' ' ' LEU . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.545 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.744 ' CE1' HG21 ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.54 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.87 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.744 HG21 ' CE1' ' A' ' 128' ' ' TYR . 20.6 p -101.39 70.64 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.63 109.211 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 83.7 m-20 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.723 -0.843 . . . . 6.48 108.723 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.561 HG22 ' SG ' ' A' ' 25' ' ' CYS . 14.2 t . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 109.281 -0.637 . . . . 18.7 109.281 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p -73.73 157.21 36.92 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.223 -0.923 . . . . 15.97 109.565 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.8 HG21 HG22 ' A' ' 132' ' ' THR . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.26 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' CD2' ' A' ' 111' ' ' PHE . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.676 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 18' ' ' GLU . 62.4 m-20 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.561 ' SG ' HG22 ' A' ' 5' ' ' VAL . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD21 ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.52 ' HE1' HD13 ' A' ' 43' ' ' ILE . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 30' ' ' PHE . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.405 ' HZ1' ' HB2' ' A' ' 107' ' ' GLN . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.542 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.597 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.542 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 0.3 OUTLIER -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.409 ' HA ' HH22 ' A' ' 88' ' ' ARG . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.437 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 96' ' ' LEU . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.627 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.577 HH11 ' HG2' ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.771 ' CZ ' HG21 ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.42 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.523 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.87 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.8 HG22 HG21 ' A' ' 10' ' ' VAL . 22.2 p -101.25 67.61 1.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.63 110.189 -179.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 41.3 m-20 . . . . . 0 N--CA 1.493 1.725 0 O-C-N 120.998 -1.064 . . . . 6.48 108.991 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.506 HG22 ' SG ' ' A' ' 25' ' ' CYS . 46.8 t . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 109.149 -0.685 . . . . 18.7 109.149 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p -74.44 159.26 32.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.169 -0.957 . . . . 15.97 109.353 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 132' ' ' THR . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.26 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 111' ' ' PHE . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.491 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.469 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' HG22 ' A' ' 5' ' ' VAL . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 30' ' ' PHE . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.456 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.472 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 81' ' ' VAL . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.565 HD13 ' NH1' ' A' ' 88' ' ' ARG . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.565 ' NH1' HD13 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.513 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.493 ' HG3' HD22 ' A' ' 17' ' ' LEU . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.485 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.87 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 17.7 p -107.77 74.79 0.97 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.63 109.347 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 59.6 m-80 . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.061 -1.024 . . . . 6.48 108.45 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 109.366 -0.605 . . . . 18.7 109.366 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p -75.74 163.23 27.49 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.235 -0.916 . . . . 15.97 109.674 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.456 HE22 ' H ' ' A' ' 133' ' ' ASN . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.681 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.749 HG21 HG22 ' A' ' 132' ' ' THR . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.47 ' CD1' ' N ' ' A' ' 13' ' ' TRP . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.26 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 111' ' ' PHE . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.419 ' O ' HD21 ' A' ' 27' ' ' LEU . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.681 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.689 ' CE2' HD11 ' A' ' 34' ' ' LEU . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.689 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.419 ' ND2' HD12 ' A' ' 110' ' ' ILE . 10.7 m120 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.639 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.639 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.426 HG22 ' H ' ' A' ' 81' ' ' VAL . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.445 HH12 HD13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.503 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.503 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.488 ' CD ' ' NZ ' ' A' ' 53' ' ' LYS . 7.9 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.419 HD12 ' ND2' ' A' ' 42' ' ' ASN . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.514 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.46 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.924 ' CZ ' HG21 ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.87 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.924 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 40.0 p -117.12 83.02 1.91 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.63 109.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.456 ' H ' HE22 ' A' ' 7' ' ' GLN . 10.4 m120 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 108.328 -0.99 . . . . 6.48 108.328 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.44 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 40.9 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.17 -0.678 . . . . 18.7 109.17 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p -75.85 168.54 19.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.32 -0.863 . . . . 15.97 109.565 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.655 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.26 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.489 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.566 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.408 HD21 ' HA ' ' A' ' 19' ' ' ASN . 9.8 m120 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.465 ' O ' HD21 ' A' ' 27' ' ' LEU . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.655 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.44 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.826 ' CE2' HD11 ' A' ' 34' ' ' LEU . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.826 HD11 ' CE2' ' A' ' 30' ' ' PHE . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.435 ' O ' ' OG ' ' A' ' 39' ' ' SER . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.442 ' CD ' ' OE1' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.57 ' CE2' HG21 ' A' ' 73' ' ' ILE . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.604 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.57 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.408 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.604 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.442 ' OE1' ' CD ' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.566 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.491 ' SD ' HD21 ' A' ' 17' ' ' LEU . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.436 HH11 ' HG2' ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.87 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p -103.51 70.4 1.03 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.63 108.923 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 6.48 108.701 179.95 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 109.275 -0.639 . . . . 18.7 109.275 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p -71.96 159.43 34.25 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.279 -0.888 . . . . 15.97 109.365 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.682 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.77 HG21 HG22 ' A' ' 132' ' ' THR . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.26 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' CD2' ' A' ' 111' ' ' PHE . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 67.1 m-20 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.682 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.716 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.553 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.687 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.496 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.441 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.441 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.541 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.661 ' C ' HD23 ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.469 ' CB ' ' NH1' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.496 HH11 ' HG2' ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.816 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.479 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.87 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.816 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.5 p -115.15 81.57 1.6 Allowed 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.63 108.649 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 39.2 m-80 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 121.323 -0.861 . . . . 6.48 109.136 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.467 HG22 ' SG ' ' A' ' 25' ' ' CYS . 75.6 t . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.314 0.578 . . . . 18.7 109.959 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p -77.97 160.99 27.85 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.448 -0.782 . . . . 15.97 109.196 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 10' ' ' VAL . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.571 HG21 HG23 ' A' ' 132' ' ' THR . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.26 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.557 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.486 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 69.2 m-20 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.467 ' SG ' HG22 ' A' ' 5' ' ' VAL . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 23' ' ' HIS . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.486 HD21 ' O ' ' A' ' 21' ' ' ILE . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.82 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.82 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.546 HD13 ' HE2' ' A' ' 30' ' ' PHE . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.676 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' NZ ' HD11 ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 ' NZ ' ' A' ' 64' ' ' LYS . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.403 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.555 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.592 ' ND2' ' CD1' ' A' ' 110' ' ' ILE . 0.4 OUTLIER -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.442 HH11 ' HG2' ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.676 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.592 ' CD1' ' ND2' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.557 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.415 HH11 ' HG2' ' A' ' 120' ' ' ARG . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.87 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.571 HG23 HG21 ' A' ' 10' ' ' VAL . 9.3 p -104.75 78.82 1.47 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.63 108.943 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 14.0 m120 . . . . . 0 C--N 1.294 -1.836 0 N-CA-C 107.469 -1.308 . . . . 6.48 107.469 179.094 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 107.726 -1.213 . . . . 18.7 107.726 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p -74.95 160.57 30.41 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.079 -1.013 . . . . 15.97 110.172 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.457 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.26 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.81 HD23 ' CD2' ' A' ' 111' ' ' PHE . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.456 ' O ' HD21 ' A' ' 27' ' ' LEU . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.474 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 21' ' ' ILE . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.776 ' CE2' HD11 ' A' ' 34' ' ' LEU . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.776 HD11 ' CE2' ' A' ' 30' ' ' PHE . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.488 ' O ' ' OG ' ' A' ' 39' ' ' SER . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.421 ' ND2' HD12 ' A' ' 110' ' ' ILE . 8.5 m120 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CE2' HG21 ' A' ' 73' ' ' ILE . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.429 ' H ' HG22 ' A' ' 75' ' ' VAL . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.421 HD12 ' ND2' ' A' ' 42' ' ' ASN . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.81 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.5 HH11 ' HG2' ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.516 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.87 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.516 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p -116.76 80.42 1.47 Allowed 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.63 109.348 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.8 m120 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.757 -0.831 . . . . 6.48 108.757 179.367 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.0 t . . . . . 0 N--CA 1.5 2.043 0 N-CA-C 109.086 -0.709 . . . . 18.7 109.086 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p -72.91 159.09 34.26 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.465 -0.772 . . . . 15.97 109.121 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.861 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.26 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.861 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.447 ' HG ' ' HE2' ' A' ' 53' ' ' LYS . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.547 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.547 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.605 ' H ' HD21 ' A' ' 42' ' ' ASN . 11.1 p30 -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.466 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.44 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.44 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.623 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.424 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.466 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.478 HD22 ' ND2' ' A' ' 82' ' ' ASN . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.505 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.765 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.479 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.87 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.479 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p -113.63 67.24 0.67 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.63 110.427 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.532 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 34.0 m120 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.002 -1.061 . . . . 6.48 108.258 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.496 1.826 0 N-CA-C 108.543 -0.91 . . . . 18.7 108.543 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p -72.17 154.35 41.1 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.952 -1.092 . . . . 15.97 108.445 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.446 HG23 ' N ' ' A' ' 11' ' ' LYS . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.446 ' N ' HG23 ' A' ' 10' ' ' VAL . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.26 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 111' ' ' PHE . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.407 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.854 ' CE2' HD11 ' A' ' 34' ' ' LEU . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.854 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.597 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.597 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.412 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 5.5 p30 -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.416 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.481 HH11 ' HG2' ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 98' ' ' PRO . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 49' ' ' CYS . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.441 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.567 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.423 ' HG2' ' NH1' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.827 ' H ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.462 ' O ' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.87 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 16.7 p -106.88 67.88 0.72 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.63 109.754 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 20.0 m120 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.17 -1.048 . . . . 6.48 108.17 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.56 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 63.0 t . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.276 0.56 . . . . 18.7 109.938 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p -70.98 153.91 42.26 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.24 -1.022 . . . . 15.97 108.24 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.64 HG21 HG22 ' A' ' 132' ' ' THR . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.406 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.26 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.425 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.4 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.562 ' O ' HD21 ' A' ' 27' ' ' LEU . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.56 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 21' ' ' ILE . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 34' ' ' LEU . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 30' ' ' PHE . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' O ' HG22 ' A' ' 43' ' ' ILE . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.613 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.613 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 75' ' ' VAL . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.401 ' ND2' HD23 ' A' ' 113' ' ' LEU . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 83' ' ' LEU . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.478 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.409 HD13 ' HA ' ' A' ' 110' ' ' ILE . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.401 HD23 ' ND2' ' A' ' 82' ' ' ASN . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.425 ' OH ' ' C ' ' A' ' 16' ' ' SER . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.515 ' CD2' ' OG1' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.418 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.87 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.64 HG22 HG21 ' A' ' 10' ' ' VAL . 6.2 p -118.12 87.42 2.72 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.63 108.712 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.418 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 7.6 m120 . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.612 -1.305 . . . . 6.48 108.155 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 108.768 -0.827 . . . . 18.7 108.768 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p -73.99 157.82 35.47 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.197 -0.939 . . . . 15.97 109.113 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.701 HG21 HG22 ' A' ' 132' ' ' THR . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.521 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.26 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.785 HD12 ' CE1' ' A' ' 119' ' ' TYR . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.694 ' CD2' HD11 ' A' ' 34' ' ' LEU . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HA ' HD12 ' A' ' 34' ' ' LEU . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.694 HD11 ' CD2' ' A' ' 30' ' ' PHE . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.433 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.615 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.526 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.559 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.526 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.44 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.442 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.625 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.48 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.48 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.785 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 121' ' ' ARG . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.434 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.514 HH11 ' HG2' ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.87 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.4 p -109.92 78.3 1.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.63 108.561 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 C--N 1.299 -1.617 0 N-CA-C 108.566 -0.902 . . . . 6.48 108.566 -179.646 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 121.199 0.523 . . . . 18.7 109.739 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p -78.44 150.25 33.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.398 -0.814 . . . . 15.97 109.135 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 81.8 mm-40 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.672 ' HG2' ' HE2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.649 HG21 HG22 ' A' ' 132' ' ' THR . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.26 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.9 HD21 ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.483 ' O ' HD21 ' A' ' 27' ' ' LEU . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 9' ' ' GLU . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.483 HD21 ' O ' ' A' ' 21' ' ' ILE . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.852 ' CE2' HD11 ' A' ' 34' ' ' LEU . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.852 HD11 ' CE2' ' A' ' 30' ' ' PHE . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.408 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.519 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.442 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.408 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.467 ' HB3' ' OE2' ' A' ' 80' ' ' GLU . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.467 ' OE2' ' HB3' ' A' ' 77' ' ' ALA . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.441 HD22 HD21 ' A' ' 113' ' ' LEU . 5.4 p30 -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.451 ' HG1' ' HE3' ' A' ' 109' ' ' LYS . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.401 HG21 ' CE2' ' A' ' 103' ' ' PHE . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.462 HH11 ' HG2' ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 91' ' ' THR . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.406 ' HA ' ' HZ1' ' A' ' 53' ' ' LYS . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.519 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HE3' ' HG1' ' A' ' 87' ' ' THR . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.873 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.441 HD21 HD22 ' A' ' 82' ' ' ASN . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.9 ' SD ' HD21 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB2' HD22 ' A' ' 17' ' ' LEU . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.422 ' HG3' HH11 ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.415 ' HG2' ' NH1' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.735 ' CE1' HG21 ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.446 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.87 108.01 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.735 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p -117.92 91.88 3.69 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.63 107.911 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 9.7 m120 . . . . . 0 C--N 1.293 -1.853 0 O-C-N 121.05 -1.031 . . . . 6.48 108.708 -179.23 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 109.475 -0.565 . . . . 18.7 109.475 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p -77.63 160.69 28.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 15.97 110.042 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.26 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.438 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 111' ' ' PHE . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 83.7 m-20 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.533 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 34' ' ' LEU . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.587 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.509 HD21 HG23 ' A' ' 110' ' ' ILE . 3.8 m120 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.457 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.457 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ3' ' HA ' ' A' ' 52' ' ' TYR . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.634 ' CE2' HG21 ' A' ' 73' ' ' ILE . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.509 HG23 HD21 ' A' ' 42' ' ' ASN . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.503 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.46 ' SD ' HD21 ' A' ' 17' ' ' LEU . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.486 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.401 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.87 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.486 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 36.0 p -104.06 56.1 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.63 110.946 -178.134 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.401 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 12.7 m120 . . . . . 0 N--CA 1.495 1.79 0 O-C-N 120.713 -1.242 . . . . 6.48 107.952 178.911 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.496 1.838 0 N-CA-C 109.038 -0.727 . . . . 18.7 109.038 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p -73.96 160.11 31.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.296 -0.878 . . . . 15.97 109.923 -179.687 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.728 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.684 HG21 HG22 ' A' ' 132' ' ' THR . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.26 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.654 ' O ' HD21 ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.728 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.654 HD21 ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.687 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.687 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.465 ' O ' ' OG ' ' A' ' 39' ' ' SER . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 73' ' ' ILE . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.509 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 53' ' ' LYS . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.554 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.509 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.528 HG22 ' SD ' ' A' ' 114' ' ' MET . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.528 ' SD ' HG22 ' A' ' 110' ' ' ILE . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' PHE . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' HH11 ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.835 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.417 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.437 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.87 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.835 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 43.3 p -97.69 65.29 1.85 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.63 109.313 179.572 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.437 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 97.8 m-20 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 6.48 109.115 -179.722 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 108.448 -0.945 . . . . 18.7 108.448 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p -77.16 159.34 29.81 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.398 -0.814 . . . . 15.97 109.512 -179.601 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.642 HG21 HG22 ' A' ' 132' ' ' THR . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.26 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.509 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.429 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.945 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.945 HD11 ' CE2' ' A' ' 30' ' ' PHE . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 43' ' ' ILE . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 40' ' ' GLU . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 49' ' ' CYS . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' A' ' 88' ' ' ARG . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.404 HH21 ' CG ' ' A' ' 90' ' ' GLU . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.509 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.418 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 116' ' ' LYS . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.506 HH11 ' HG2' ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.409 HD23 ' CE1' ' A' ' 128' ' ' TYR . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.817 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.519 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.87 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.817 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 25.3 p -102.45 62.19 0.85 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.63 110.063 -179.23 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 15.7 m120 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.136 -0.977 . . . . 6.48 109.195 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.461 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 15.7 t . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 121.419 0.628 . . . . 18.7 109.596 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p -79.91 170.1 16.95 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.424 -0.798 . . . . 15.97 109.776 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.591 HG21 HG22 ' A' ' 132' ' ' THR . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.26 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.461 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.837 ' CE2' HD11 ' A' ' 34' ' ' LEU . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.837 HD11 ' CE2' ' A' ' 30' ' ' PHE . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.614 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.568 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.568 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.4 HD21 HD11 ' A' ' 110' ' ' ILE . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.504 ' OD2' ' SG ' ' A' ' 86' ' ' CYS . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.501 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.426 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.614 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 HD21 ' A' ' 83' ' ' LEU . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.512 ' CD ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.506 ' CZ ' HG21 ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.87 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.591 HG22 HG21 ' A' ' 10' ' ' VAL . 4.5 p -116.85 82.98 1.89 Allowed 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.63 108.797 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 5.2 m120 . . . . . 0 C--N 1.295 -1.783 0 O-C-N 120.976 -1.077 . . . . 6.48 108.254 -179.554 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 108.557 -0.905 . . . . 18.7 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p -74.19 156.81 36.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.067 -1.021 . . . . 15.97 110.087 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.548 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 HG22 ' A' ' 132' ' ' THR . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.26 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.579 HD23 ' CD2' ' A' ' 111' ' ' PHE . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.605 ' O ' HD21 ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.548 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.605 HD21 ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.8 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 30' ' ' PHE . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.663 ' CE2' HG21 ' A' ' 73' ' ' ILE . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.663 HG21 ' CE2' ' A' ' 69' ' ' TYR . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.514 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.48 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.425 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.425 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.436 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.514 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.545 HG22 ' SD ' ' A' ' 114' ' ' MET . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.579 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 110' ' ' ILE . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 122' ' ' PHE . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.87 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p -119.98 83.27 2.02 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.63 108.383 179.159 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.2 m120 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 120.421 -1.425 . . . . 6.48 108.566 -179.424 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.498 1.971 0 N-CA-C 109.062 -0.718 . . . . 18.7 109.062 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p -72.02 157.39 37.89 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.257 -0.902 . . . . 15.97 109.595 -179.64 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.489 ' OE1' ' N ' ' A' ' 133' ' ' ASN . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.688 HG21 HG22 ' A' ' 132' ' ' THR . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' HG23 ' A' ' 10' ' ' VAL . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.26 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.518 ' N ' ' OE1' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.537 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.565 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.496 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.565 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CE2' HD11 ' A' ' 34' ' ' LEU . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD11 ' CE2' ' A' ' 30' ' ' PHE . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.616 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.721 ' CE2' HG21 ' A' ' 73' ' ' ILE . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.581 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.721 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.581 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.538 HD12 ' NH1' ' A' ' 88' ' ' ARG . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.513 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.65 ' ND2' ' SG ' ' A' ' 102' ' ' CYS . 83.3 m-20 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.65 ' SG ' ' ND2' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.513 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.515 HH11 ' HG2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.899 ' CZ ' HG21 ' A' ' 132' ' ' THR . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.87 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.899 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 63.9 p -98.03 67.06 1.89 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.63 110.293 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.489 ' N ' ' OE1' ' A' ' 7' ' ' GLN . 18.3 m-20 . . . . . 0 C--N 1.299 -1.602 0 N-CA-C 107.165 -1.42 . . . . 6.48 107.165 178.189 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.068 -0.716 . . . . 18.7 109.068 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p -73.11 161.02 31.11 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.108 -0.995 . . . . 15.97 109.61 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.471 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.26 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.776 HD23 ' CD2' ' A' ' 111' ' ' PHE . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.491 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.525 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.503 HD21 ' CE2' ' A' ' 30' ' ' PHE . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.517 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.461 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.43 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.47 HG21 ' CE2' ' A' ' 69' ' ' TYR . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.452 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.435 ' N ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.5 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.663 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 99' ' ' THR . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.418 HG23 ' O ' ' A' ' 97' ' ' GLU . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.5 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.776 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.583 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.506 ' HG3' HD22 ' A' ' 17' ' ' LEU . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.471 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.508 HH11 ' HG2' ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.468 ' CB ' ' NH1' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.557 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.87 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.557 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p -117.57 95.29 4.88 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.63 106.64 177.621 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 . . . . . 0 C--N 1.289 -2.059 0 C-N-CA 119.894 -0.722 . . . . 6.48 109.48 -178.202 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 35.5 t . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 121.11 0.481 . . . . 18.7 109.841 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p -76.31 158.65 31.3 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 15.97 108.815 179.267 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.608 HG21 HG22 ' A' ' 132' ' ' THR . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.26 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.671 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.664 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 ' CE2' ' A' ' 30' ' ' PHE . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HZ3' ' CD ' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.538 ' O ' HD13 ' A' ' 100' ' ' ILE . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 73' ' ' ILE . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 73' ' ' ILE . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.558 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.4 OUTLIER -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.406 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.538 HD13 ' O ' ' A' ' 55' ' ' ILE . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.702 ' CD ' ' HZ3' ' A' ' 53' ' ' LYS . 15.0 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.431 ' NZ ' ' CG ' ' A' ' 84' ' ' ASP . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.671 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.529 ' O ' ' N ' ' A' ' 122' ' ' PHE . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.4 ' CA ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.419 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.87 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.608 HG22 HG21 ' A' ' 10' ' ' VAL . 18.8 p -112.4 69.92 0.7 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.63 109.685 -179.391 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 12.8 m120 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 120.949 -1.094 . . . . 6.48 108.539 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.389 0.614 . . . . 18.7 109.696 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p -77.09 161.16 28.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 15.97 109.358 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG21 HG22 ' A' ' 132' ' ' THR . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 12' ' ' LYS . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 23' ' ' HIS . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.26 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 11' ' ' LYS . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.629 HD23 ' CD2' ' A' ' 111' ' ' PHE . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CB ' ' HE1' ' A' ' 13' ' ' TRP . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.682 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.682 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.455 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' HA ' HD13 ' A' ' 34' ' ' LEU . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.597 ' ND2' HD12 ' A' ' 110' ' ' ILE . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HA ' ' A' ' 43' ' ' ILE . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.401 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.552 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.536 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.597 HD12 ' ND2' ' A' ' 42' ' ' ASN . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.629 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.439 ' HG3' HD22 ' A' ' 17' ' ' LEU . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.437 ' OH ' ' C ' ' A' ' 16' ' ' SER . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.619 ' NH2' ' NZ ' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.404 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.619 ' NZ ' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.843 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.87 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.843 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 11.5 p -110.56 72.93 0.8 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.63 110.332 -179.302 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.509 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 74.3 m-80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 107.182 -1.414 . . . . 6.48 107.182 178.561 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.544 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 74.4 t . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 121.637 0.732 . . . . 18.7 109.922 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p -78.14 152.47 32.75 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.852 -0.53 . . . . 15.97 109.629 179.654 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.617 HG21 HG22 ' A' ' 132' ' ' THR . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.26 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.803 HD23 ' CD2' ' A' ' 111' ' ' PHE . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 18' ' ' GLU . 29.0 m-20 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OE2' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 34' ' ' LEU . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.734 HD11 ' CE2' ' A' ' 30' ' ' PHE . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 ' CE1' ' A' ' 69' ' ' TYR . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 75' ' ' VAL . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.644 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.644 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.508 ' HZ3' ' HB3' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.457 HG22 ' SD ' ' A' ' 114' ' ' MET . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.803 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' HG22 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.472 ' HB2' HD22 ' A' ' 17' ' ' LEU . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.437 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.5 ' N ' ' CD ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.76 ' CE1' HG21 ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.87 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.76 HG21 ' CE1' ' A' ' 128' ' ' TYR . 5.6 p -115.57 81.86 1.66 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.63 108.213 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.2 m120 . . . . . 0 C--N 1.292 -1.927 0 O-C-N 120.868 -1.145 . . . . 6.48 108.031 -179.33 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 109.204 -0.665 . . . . 18.7 109.204 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.435 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p -77.0 162.96 27.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 15.97 110.098 -179.714 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.435 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.598 HG21 HG22 ' A' ' 132' ' ' THR . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.598 ' CB ' ' HZ3' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.26 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 27' ' ' LEU . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 21' ' ' ILE . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.669 ' CE2' HD11 ' A' ' 34' ' ' LEU . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HA ' HD12 ' A' ' 34' ' ' LEU . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.669 HD11 ' CE2' ' A' ' 30' ' ' PHE . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.487 ' OG ' HD23 ' A' ' 34' ' ' LEU . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' A' ' 34' ' ' LEU . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.519 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG21 ' CE2' ' A' ' 69' ' ' TYR . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.55 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.55 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.475 ' CB ' ' NH1' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.514 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.459 ' HG3' HH11 ' A' ' 120' ' ' ARG . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.495 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.711 ' CZ ' HG21 ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.87 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.711 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.2 p -107.94 72.46 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.63 109.31 -179.763 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 130' ' ' ASP . 28.2 m120 . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 108.461 -0.94 . . . . 6.48 108.461 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.196 -0.668 . . . . 15.970000000000001 109.196 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' N ' ' A' ' 11' ' ' LYS . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.452 ' N ' HG23 ' A' ' 10' ' ' VAL . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.2599999999999998 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.925 HD11 ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.656 ' O ' HD21 ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.517 HD21 HD21 ' A' ' 82' ' ' ASN . 93.3 m-20 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HA ' HD11 ' A' ' 100' ' ' ILE . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE1' HG21 ' A' ' 73' ' ' ILE . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' VAL . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.517 HD21 HD21 ' A' ' 42' ' ' ASN . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.478 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.478 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.489 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.432 HH11 ' HG3' ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.592 ' N ' HD12 ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.475 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.657 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.925 ' SD ' HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.648 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.516 ' HG2' HH11 ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.552 ' CZ ' HG21 ' A' ' 132' ' ' THR . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.8700000000000001 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.552 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 27.5 p . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.6299999999999999 109.516 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 121.227 0.537 . . . . 15.970000000000001 109.633 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.875 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.662 HG21 HG22 ' A' ' 132' ' ' THR . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' CB ' ' NZ ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.2599999999999998 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.934 HD23 ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.583 ' O ' HD21 ' A' ' 27' ' ' LEU . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.875 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 21' ' ' ILE . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.556 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.665 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HA ' HD13 ' A' ' 100' ' ' ILE . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.665 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.517 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.517 HG21 ' CE2' ' A' ' 69' ' ' TYR . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.483 ' HG2' HH11 ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.603 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 56' ' ' LYS . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.934 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.55 ' HB2' HD22 ' A' ' 17' ' ' LEU . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.548 HH11 ' HG2' ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.8700000000000001 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 128' ' ' TYR . 6.8 p . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.6299999999999999 109.44 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.0 p . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 121.491 0.662 . . . . 15.970000000000001 109.97 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.427 ' HG3' ' HE2' ' A' ' 23' ' ' HIS . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 131' ' ' LEU . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.2599999999999998 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.844 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.427 ' HE2' ' HG3' ' A' ' 9' ' ' GLU . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.435 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.63 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.506 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' A' ' 64' ' ' LYS . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.689 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.689 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.4 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.657 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.527 HD12 ' NH1' ' A' ' 88' ' ' ARG . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.535 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.575 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.575 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.506 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.454 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.535 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.844 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.584 ' SD ' HD21 ' A' ' 17' ' ' LEU . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 17' ' ' LEU . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.495 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.688 ' CZ ' HG21 ' A' ' 132' ' ' THR . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 10' ' ' VAL . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.8700000000000001 109.078 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.688 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 82.0 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.6299999999999999 110.004 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 108.845 -0.798 . . . . 15.970000000000001 108.845 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.405 HG21 ' CG2' ' A' ' 132' ' ' THR . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.2599999999999998 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.742 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.414 ' CB ' ' NZ ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' A' ' 30' ' ' PHE . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.483 HD21 HD21 ' A' ' 82' ' ' ASN . 98.4 m-20 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.441 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.441 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 81' ' ' VAL . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.541 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.534 ' HG2' HH11 ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.571 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.571 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.541 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.545 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.519 ' SD ' HD21 ' A' ' 17' ' ' LEU . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.495 ' HG2' HH11 ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.418 ' O ' ' OG1' ' A' ' 132' ' ' THR . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.404 ' CG ' ' O ' ' A' ' 126' ' ' ARG . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.8700000000000001 108.697 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 80.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.6299999999999999 108.122 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 109.49 -0.559 . . . . 15.970000000000001 109.49 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 132' ' ' THR . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' HG23 ' A' ' 10' ' ' VAL . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.2599999999999998 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.5 HD21 ' SD ' ' A' ' 114' ' ' MET . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.792 ' CE2' HD11 ' A' ' 34' ' ' LEU . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.478 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.792 HD11 ' CE2' ' A' ' 30' ' ' PHE . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.528 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.618 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.764 HD21 HD21 ' A' ' 82' ' ' ASN . 97.9 m-20 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.559 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.664 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.664 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.475 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.475 HG21 ' CE1' ' A' ' 69' ' ' TYR . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.443 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.764 HD21 HD21 ' A' ' 42' ' ' ASN . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.417 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.527 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 100' ' ' ILE . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.527 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.442 HH11 ' HG3' ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.8700000000000001 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.6299999999999999 109.743 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.492 1.625 0 N-CA-C 109.243 -0.651 . . . . 15.970000000000001 109.243 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.568 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.854 HG21 HG22 ' A' ' 132' ' ' THR . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.48 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.2599999999999998 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.502 HD23 ' CD2' ' A' ' 111' ' ' PHE . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.457 ' O ' HD21 ' A' ' 27' ' ' LEU . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.568 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 21' ' ' ILE . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' A' ' 34' ' ' LEU . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.813 HD11 ' CE2' ' A' ' 30' ' ' PHE . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.557 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.578 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.557 ' ND2' ' OG ' ' A' ' 39' ' ' SER . 98.6 m-20 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.404 HG23 ' N ' ' A' ' 44' ' ' ASP . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 43' ' ' ILE . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.542 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.488 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.424 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.522 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 29.1 m120 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.522 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.648 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.502 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.404 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 119' ' ' TYR . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 122' ' ' PHE . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.48 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.667 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.8700000000000001 109.792 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.854 HG22 HG21 ' A' ' 10' ' ' VAL . 64.1 p . . . . . 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.6299999999999999 110.145 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 121.428 0.633 . . . . 15.970000000000001 109.566 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 HG22 ' A' ' 132' ' ' THR . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.2599999999999998 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.483 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.483 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 94.2 m-20 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.407 ' O ' HD21 ' A' ' 27' ' ' LEU . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.3 m120 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.532 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.532 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.407 HD21 ' O ' ' A' ' 21' ' ' ILE . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.613 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.613 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.402 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' HG21 ' A' ' 73' ' ' ILE . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.418 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.411 ' N ' ' OD2' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.552 ' HG2' HH11 ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.511 ' HA ' ' HZ3' ' A' ' 108' ' ' LYS . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.511 ' HZ3' ' HA ' ' A' ' 105' ' ' GLU . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.623 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.428 ' SD ' HD21 ' A' ' 17' ' ' LEU . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.545 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.744 ' CE1' HG21 ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.8700000000000001 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.744 HG21 ' CE1' ' A' ' 128' ' ' TYR . 20.6 p . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.6299999999999999 109.211 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 121.295 0.569 . . . . 15.970000000000001 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.8 HG21 HG22 ' A' ' 132' ' ' THR . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.2599999999999998 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' CD2' ' A' ' 111' ' ' PHE . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.676 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.3 m120 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD21 ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.52 ' HE1' HD13 ' A' ' 43' ' ' ILE . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.543 ' ND2' HD12 ' A' ' 110' ' ' ILE . 14.5 m120 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 30' ' ' PHE . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.405 ' HZ1' ' HB2' ' A' ' 107' ' ' GLN . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.542 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.597 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.542 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 5.1 p30 -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.409 ' HA ' HH22 ' A' ' 88' ' ' ARG . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.437 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 96' ' ' LEU . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.543 HD12 ' ND2' ' A' ' 42' ' ' ASN . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.627 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.577 ' HG2' HH11 ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.771 ' CZ ' HG21 ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.8700000000000001 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.8 HG22 HG21 ' A' ' 10' ' ' VAL . 22.2 p . . . . . 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.6299999999999999 110.189 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.353 -0.61 . . . . 15.970000000000001 109.353 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 132' ' ' THR . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.2599999999999998 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 111' ' ' PHE . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.491 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.469 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 30' ' ' PHE . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.456 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.556 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.472 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 81' ' ' VAL . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.565 HD13 ' NH1' ' A' ' 88' ' ' ARG . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.565 ' NH1' HD13 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.556 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 17.6 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.513 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.493 ' HG3' HD22 ' A' ' 17' ' ' LEU . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.8700000000000001 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 17.7 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.6299999999999999 109.347 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.361 0.601 . . . . 15.970000000000001 109.674 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.681 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.749 HG21 HG22 ' A' ' 132' ' ' THR . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.47 ' N ' ' CD1' ' A' ' 13' ' ' TRP . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.2599999999999998 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 111' ' ' PHE . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.419 ' O ' HD21 ' A' ' 27' ' ' LEU . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.681 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.689 ' CE2' HD11 ' A' ' 34' ' ' LEU . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.689 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.722 HD21 HD21 ' A' ' 82' ' ' ASN . 96.1 m-20 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.606 ' HZ1' ' CD ' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.639 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.639 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.426 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.722 HD21 HD21 ' A' ' 42' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.445 HH12 HD13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.503 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.503 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.606 ' CD ' ' HZ1' ' A' ' 53' ' ' LYS . 43.2 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.514 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.46 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.924 ' CZ ' HG21 ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.8700000000000001 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.924 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 40.0 p . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.6299999999999999 109.183 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.565 -0.531 . . . . 15.970000000000001 109.565 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.655 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.2599999999999998 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.509 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.566 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.509 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 91.3 m-20 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.465 ' O ' HD21 ' A' ' 27' ' ' LEU . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.655 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.826 ' CE2' HD11 ' A' ' 34' ' ' LEU . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.826 HD11 ' CE2' ' A' ' 30' ' ' PHE . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.513 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.712 HD21 ' ND2' ' A' ' 82' ' ' ASN . 98.5 m-20 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.442 ' CD ' ' OE1' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.57 ' CE2' HG21 ' A' ' 73' ' ' ILE . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.604 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.57 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.408 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.604 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.712 ' ND2' HD21 ' A' ' 42' ' ' ASN . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.442 ' OE1' ' CD ' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.566 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.491 ' SD ' HD21 ' A' ' 17' ' ' LEU . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.436 ' HG2' HH11 ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.8700000000000001 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.6299999999999999 108.923 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 121.445 0.641 . . . . 15.970000000000001 109.365 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.682 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.77 HG21 HG22 ' A' ' 132' ' ' THR . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.2599999999999998 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' CD2' ' A' ' 111' ' ' PHE . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.1 m120 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.682 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.716 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.553 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.687 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.496 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.441 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.441 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.541 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.661 HD23 ' C ' ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.469 ' NH1' ' CB ' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.496 ' HG2' HH11 ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.816 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.8700000000000001 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.816 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.5 p . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.6299999999999999 108.649 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 109.196 -0.668 . . . . 15.970000000000001 109.196 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 10' ' ' VAL . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.571 HG21 HG23 ' A' ' 132' ' ' THR . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.2599999999999998 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.557 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.486 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.7 m120 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 23' ' ' HIS . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.486 HD21 ' O ' ' A' ' 21' ' ' ILE . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.82 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.82 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.733 HD21 HD21 ' A' ' 82' ' ' ASN . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.546 HD13 ' HE2' ' A' ' 30' ' ' PHE . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.676 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.42 ' NZ ' HD11 ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 ' NZ ' ' A' ' 64' ' ' LYS . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.403 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.555 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.733 HD21 HD21 ' A' ' 42' ' ' ASN . 5.2 p30 -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.676 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.557 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.415 ' HG2' HH11 ' A' ' 120' ' ' ARG . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.431 ' HG2' HH11 ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.8700000000000001 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.571 HG23 HG21 ' A' ' 10' ' ' VAL . 9.3 p . . . . . 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.6299999999999999 108.943 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.52 0.676 . . . . 15.970000000000001 110.172 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.457 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.2599999999999998 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.81 HD23 ' CD2' ' A' ' 111' ' ' PHE . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.456 ' O ' HD21 ' A' ' 27' ' ' LEU . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.474 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 21' ' ' ILE . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.776 ' CE2' HD11 ' A' ' 34' ' ' LEU . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.776 HD11 ' CE2' ' A' ' 30' ' ' PHE . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.525 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.705 HD21 HD21 ' A' ' 82' ' ' ASN . 99.2 m-20 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CE2' HG21 ' A' ' 73' ' ' ILE . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.429 ' H ' HG22 ' A' ' 75' ' ' VAL . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.705 HD21 HD21 ' A' ' 42' ' ' ASN . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.81 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.5 ' HG2' HH11 ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.516 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.8700000000000001 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.516 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.6299999999999999 109.348 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.121 -0.696 . . . . 15.970000000000001 109.121 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.861 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.2599999999999998 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.861 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.447 ' HG ' ' HE2' ' A' ' 53' ' ' LYS . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.547 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.547 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 42' ' ' ASN . 0.1 OUTLIER -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.466 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.44 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.44 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.623 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.424 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.466 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.505 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.765 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.479 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.8700000000000001 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.479 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p . . . . . 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.6299999999999999 110.427 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 108.445 -0.946 . . . . 15.970000000000001 108.445 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.446 HG23 ' N ' ' A' ' 11' ' ' LYS . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.446 ' N ' HG23 ' A' ' 10' ' ' VAL . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.2599999999999998 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 111' ' ' PHE . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.407 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.854 ' CE2' HD11 ' A' ' 34' ' ' LEU . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.854 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.597 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.597 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.412 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.635 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.416 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.481 ' HG2' HH11 ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 98' ' ' PRO . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.601 ' SD ' ' N ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 49' ' ' CYS . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.441 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.567 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.423 ' NH1' ' HG2' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.827 ' HE ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.462 ' O ' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.8700000000000001 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 16.7 p . . . . . 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.6299999999999999 109.754 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.24 -1.022 . . . . 15.970000000000001 108.24 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.64 HG21 HG22 ' A' ' 132' ' ' THR . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.406 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.2599999999999998 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.464 ' HB2' HD22 ' A' ' 19' ' ' ASN . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.425 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.4 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' HB2' ' A' ' 15' ' ' GLU . 91.5 m-20 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.562 ' O ' HD21 ' A' ' 27' ' ' LEU . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 21' ' ' ILE . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 34' ' ' LEU . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 30' ' ' PHE . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' O ' HG22 ' A' ' 43' ' ' ILE . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.613 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.613 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 75' ' ' VAL . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.401 ' ND2' HD23 ' A' ' 113' ' ' LEU . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 83' ' ' LEU . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.478 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.409 HD13 ' HA ' ' A' ' 110' ' ' ILE . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.401 HD23 ' ND2' ' A' ' 82' ' ' ASN . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.425 ' OH ' ' C ' ' A' ' 16' ' ' SER . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.515 ' CD2' ' OG1' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.8700000000000001 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.64 HG22 HG21 ' A' ' 10' ' ' VAL . 6.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.6299999999999999 108.712 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 109.113 -0.699 . . . . 15.970000000000001 109.113 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.701 HG21 HG22 ' A' ' 132' ' ' THR . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.521 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.2599999999999998 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.785 HD12 ' CE1' ' A' ' 119' ' ' TYR . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.694 ' CD2' HD11 ' A' ' 34' ' ' LEU . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HA ' HD12 ' A' ' 34' ' ' LEU . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.694 HD11 ' CD2' ' A' ' 30' ' ' PHE . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.451 ' HB2' HD22 ' A' ' 42' ' ' ASN . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.615 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.451 HD22 ' HB2' ' A' ' 39' ' ' SER . 78.9 m-20 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.526 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.559 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.526 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.44 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.442 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.625 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.48 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.48 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.785 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 121' ' ' ARG . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.434 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.514 ' HG2' HH11 ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.8700000000000001 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.4 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.6299999999999999 108.561 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.135 -0.691 . . . . 15.970000000000001 109.135 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.426 HE22 ' HA ' ' A' ' 132' ' ' THR . 13.1 mm100 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.672 ' HG2' ' HE2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.649 HG21 HG22 ' A' ' 132' ' ' THR . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.2599999999999998 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.9 HD21 ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.483 ' O ' HD21 ' A' ' 27' ' ' LEU . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 9' ' ' GLU . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.483 HD21 ' O ' ' A' ' 21' ' ' ILE . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.852 ' CE2' HD11 ' A' ' 34' ' ' LEU . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.852 HD11 ' CE2' ' A' ' 30' ' ' PHE . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.408 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.519 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.442 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.408 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.467 ' HB3' ' OE2' ' A' ' 80' ' ' GLU . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.467 ' OE2' ' HB3' ' A' ' 77' ' ' ALA . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.497 ' H ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.451 ' HG1' ' HE3' ' A' ' 109' ' ' LYS . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.401 HG21 ' CE2' ' A' ' 103' ' ' PHE . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.462 ' HG2' HH11 ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 91' ' ' THR . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.406 ' HA ' ' HZ1' ' A' ' 53' ' ' LYS . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.519 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HE3' ' HG1' ' A' ' 87' ' ' THR . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.873 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.552 ' ND2' ' HZ1' ' A' ' 116' ' ' LYS . 20.3 m120 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.9 ' SD ' HD21 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB2' HD22 ' A' ' 17' ' ' LEU . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . 0.552 ' HZ1' ' ND2' ' A' ' 112' ' ' ASN . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.422 HH11 ' HG3' ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.415 ' NH1' ' HG2' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.735 ' CE1' HG21 ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.8700000000000001 108.01 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.735 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.6299999999999999 107.911 179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.706 0.765 . . . . 15.970000000000001 110.042 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.2599999999999998 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.501 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 111' ' ' PHE . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.501 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.0 m-20 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 6.0 m120 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.533 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 34' ' ' LEU . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.587 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.421 HD22 ' HG2' ' A' ' 41' ' ' GLU . 1.9 m-80 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.457 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.457 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ3' ' HA ' ' A' ' 52' ' ' TYR . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.634 ' CE2' HG21 ' A' ' 73' ' ' ILE . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.571 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 24.9 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.503 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.46 ' SD ' HD21 ' A' ' 17' ' ' LEU . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.433 HH11 ' HG3' ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.486 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.8700000000000001 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.486 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 36.0 p . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.6299999999999999 110.946 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.247 0.546 . . . . 15.970000000000001 109.923 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.728 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.684 HG21 HG22 ' A' ' 132' ' ' THR . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.2599999999999998 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.654 ' O ' HD21 ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.728 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.654 HD21 ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.687 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.687 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.564 ' CB ' HD22 ' A' ' 42' ' ' ASN . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.632 HD21 ' ND2' ' A' ' 82' ' ' ASN . 81.7 m-20 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 73' ' ' ILE . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.632 ' ND2' HD21 ' A' ' 42' ' ' ASN . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.509 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 53' ' ' LYS . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.554 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.509 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.528 HG22 ' SD ' ' A' ' 114' ' ' MET . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.528 ' SD ' HG22 ' A' ' 110' ' ' ILE . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' PHE . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.442 HH11 ' HG3' ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.835 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.8700000000000001 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.835 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 43.3 p . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.6299999999999999 109.313 179.572 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.395 0.617 . . . . 15.970000000000001 109.512 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.642 HG21 HG22 ' A' ' 132' ' ' THR . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.2599999999999998 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.509 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.429 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.945 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.945 HD11 ' CE2' ' A' ' 30' ' ' PHE . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 43' ' ' ILE . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 40' ' ' GLU . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' A' ' 88' ' ' ARG . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.404 HH21 ' CG ' ' A' ' 90' ' ' GLU . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.479 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 21.3 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.509 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.418 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 116' ' ' LYS . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.506 ' HG2' HH11 ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.409 HD23 ' CE1' ' A' ' 128' ' ' TYR . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.817 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.8700000000000001 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.817 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 25.3 p . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.6299999999999999 110.063 -179.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.35 0.595 . . . . 15.970000000000001 109.776 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.591 HG21 HG22 ' A' ' 132' ' ' THR . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.2599999999999998 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.837 ' CE2' HD11 ' A' ' 34' ' ' LEU . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.837 HD11 ' CE2' ' A' ' 30' ' ' PHE . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.523 HD21 ' ND2' ' A' ' 82' ' ' ASN . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.614 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.568 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.568 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.585 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.4 HD21 HD11 ' A' ' 110' ' ' ILE . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.504 ' OD2' ' SG ' ' A' ' 86' ' ' CYS . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.501 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.426 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.614 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 HD21 ' A' ' 83' ' ' LEU . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.512 ' H ' ' CD ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.506 ' CZ ' HG21 ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.8700000000000001 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.591 HG22 HG21 ' A' ' 10' ' ' VAL . 4.5 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.6299999999999999 108.797 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.648 0.737 . . . . 15.970000000000001 110.087 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.548 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 HG22 ' A' ' 132' ' ' THR . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.2599999999999998 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.494 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.579 HD23 ' CD2' ' A' ' 111' ' ' PHE . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.494 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.3 m-20 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.605 ' O ' HD21 ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.548 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.605 HD21 ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.8 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 30' ' ' PHE . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.663 ' CE2' HG21 ' A' ' 73' ' ' ILE . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.663 HG21 ' CE2' ' A' ' 69' ' ' TYR . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.514 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.48 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.425 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.425 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.436 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.514 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.545 HG22 ' SD ' ' A' ' 114' ' ' MET . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.579 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 110' ' ' ILE . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 122' ' ' PHE . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.8700000000000001 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.6299999999999999 108.383 179.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 121.361 0.601 . . . . 15.970000000000001 109.595 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.688 HG21 HG22 ' A' ' 132' ' ' THR . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' HG23 ' A' ' 10' ' ' VAL . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.2599999999999998 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.518 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.537 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.565 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.496 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.565 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CE2' HD11 ' A' ' 34' ' ' LEU . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD11 ' CE2' ' A' ' 30' ' ' PHE . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.616 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.721 ' CE2' HG21 ' A' ' 73' ' ' ILE . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.444 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.581 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.721 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.581 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.538 HD12 ' NH1' ' A' ' 88' ' ' ARG . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.513 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.478 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 9.2 m120 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.478 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.513 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.515 ' HG2' HH11 ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.899 ' CZ ' HG21 ' A' ' 132' ' ' THR . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.8700000000000001 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.899 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 63.9 p . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.6299999999999999 110.293 -179.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.363 0.601 . . . . 15.970000000000001 109.61 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.471 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.2599999999999998 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.776 HD23 ' CD2' ' A' ' 111' ' ' PHE . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.491 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.525 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.503 HD21 ' CE2' ' A' ' 30' ' ' PHE . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.802 ' HE1' HE21 ' A' ' 107' ' ' GLN . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.461 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.43 ' HB2' ' HZ2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.47 HG21 ' CE2' ' A' ' 69' ' ' TYR . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.452 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.435 ' N ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.5 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.663 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 99' ' ' THR . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.418 HG23 ' O ' ' A' ' 97' ' ' GLU . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.802 HE21 ' HE1' ' A' ' 46' ' ' TRP . 56.2 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.5 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.776 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.583 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.506 ' HG3' HD22 ' A' ' 17' ' ' LEU . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.471 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.508 ' HG2' HH11 ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.468 ' NH1' ' CB ' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.557 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.8700000000000001 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.557 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.6299999999999999 106.64 177.621 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 108.815 -0.809 . . . . 15.970000000000001 108.815 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.608 HG21 HG22 ' A' ' 132' ' ' THR . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.2599999999999998 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.523 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.671 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 97.9 m-20 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.664 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 ' CE2' ' A' ' 30' ' ' PHE . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.628 HD21 HD21 ' A' ' 82' ' ' ASN . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.626 ' NZ ' ' NE2' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.538 ' O ' HD13 ' A' ' 100' ' ' ILE . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 73' ' ' ILE . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 73' ' ' ILE . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.628 HD21 HD21 ' A' ' 42' ' ' ASN . 7.3 p30 -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.406 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.673 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.538 HD13 ' O ' ' A' ' 55' ' ' ILE . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 52.5 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.431 ' NZ ' ' CG ' ' A' ' 84' ' ' ASP . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.671 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.462 ' CD2' ' ND2' ' A' ' 82' ' ' ASN . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.529 ' O ' ' N ' ' A' ' 122' ' ' PHE . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.4 ' CA ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.8700000000000001 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.608 HG22 HG21 ' A' ' 10' ' ' VAL . 18.8 p . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.6299999999999999 109.685 -179.391 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.358 -0.608 . . . . 15.970000000000001 109.358 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG21 HG22 ' A' ' 132' ' ' THR . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 23' ' ' HIS . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.2599999999999998 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 11' ' ' LYS . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.629 HD23 ' CD2' ' A' ' 111' ' ' PHE . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.682 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.682 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.455 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' HA ' HD13 ' A' ' 34' ' ' LEU . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.597 ' ND2' HD12 ' A' ' 110' ' ' ILE . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HA ' ' A' ' 43' ' ' ILE . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.401 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.552 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.536 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.597 HD12 ' ND2' ' A' ' 42' ' ' ASN . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.629 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.439 ' HG3' HD22 ' A' ' 17' ' ' LEU . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.437 ' OH ' ' C ' ' A' ' 16' ' ' SER . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.619 ' NH2' ' NZ ' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.404 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.619 ' NZ ' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.843 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.8700000000000001 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.843 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 11.5 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.6299999999999999 110.332 -179.302 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.179 0.514 . . . . 15.970000000000001 109.629 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.617 HG21 HG22 ' A' ' 132' ' ' THR . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.2599999999999998 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.803 HD23 ' CD2' ' A' ' 111' ' ' PHE . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.459 HD22 ' N ' ' A' ' 22' ' ' ASN . 2.3 m120 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OE2' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 34' ' ' LEU . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.734 HD11 ' CE2' ' A' ' 30' ' ' PHE . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 ' CE1' ' A' ' 69' ' ' TYR . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.462 ' H ' HG22 ' A' ' 75' ' ' VAL . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.644 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.644 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.508 ' HB3' ' HZ3' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.457 HG22 ' SD ' ' A' ' 114' ' ' MET . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.803 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' HG22 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.472 ' HB2' HD22 ' A' ' 17' ' ' LEU . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.437 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.76 ' CE1' HG21 ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.8700000000000001 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.76 HG21 ' CE1' ' A' ' 128' ' ' TYR . 5.6 p . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.6299999999999999 108.213 179.637 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.435 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.474 0.654 . . . . 15.970000000000001 110.098 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.435 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.598 HG21 HG22 ' A' ' 132' ' ' THR . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.598 ' HZ3' ' CB ' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.2599999999999998 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 27' ' ' LEU . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 21' ' ' ILE . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.669 ' CE2' HD11 ' A' ' 34' ' ' LEU . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HA ' HD12 ' A' ' 34' ' ' LEU . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.669 HD11 ' CE2' ' A' ' 30' ' ' PHE . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.487 ' OG ' HD23 ' A' ' 34' ' ' LEU . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.768 HD21 HD21 ' A' ' 82' ' ' ASN . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' A' ' 34' ' ' LEU . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.637 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.519 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG21 ' CE2' ' A' ' 69' ' ' TYR . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.768 HD21 HD21 ' A' ' 42' ' ' ASN . 5.5 p30 -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.55 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.55 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH1' ' CB ' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.637 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 34.3 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.514 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.459 HH11 ' HG3' ' A' ' 120' ' ' ARG . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.495 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 128' ' ' TYR . . . . . 0.711 ' CZ ' HG21 ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.8700000000000001 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.711 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.2 p . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.6299999999999999 109.31 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 58.4 t . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.061 -0.718 . . . . 18.699999999999999 109.061 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.0 p -72.9 159.89 33.01 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.195 -0.941 . . . . 15.970000000000001 109.196 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -68.58 -17.46 64.14 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.291 -0.881 . . . . 13.82 108.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -70.0 -40.02 75.52 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.073 -1.017 . . . . 15.06 110.744 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -74.46 -40.77 61.68 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.195 -0.941 . . . . 14.68 111.866 -177.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' N ' ' A' ' 11' ' ' LYS . 6.4 m -60.12 -41.15 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.393 -1.442 . . . . 11.69 108.913 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.452 ' N ' HG23 ' A' ' 10' ' ' VAL . 68.3 mttm -60.05 -40.1 88.27 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.845 -1.16 . . . . 10.51 109.018 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.53 -38.3 83.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.048 -1.033 . . . . 10.82 108.486 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.4 m0 -56.63 -28.07 59.76 Favored 'General case' 0 C--O 1.201 -1.457 0 O-C-N 121.261 -0.899 . . . . 6.2599999999999998 108.997 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.28 -10.31 58.61 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.348 -1.47 . . . . 0.01 109.103 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.6 -24.63 17.13 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.274 -0.891 . . . . 0.01 111.445 -179.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 80.2 p -169.99 141.73 2.23 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.168 -1.583 . . . . 0.01 111.366 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.925 HD11 ' SD ' ' A' ' 114' ' ' MET . 13.0 tp -59.8 -37.94 80.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.773 -0.579 . . . . 0.01 109.53 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -56.06 -40.05 72.99 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.464 -0.772 . . . . 0.01 110.512 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -61.31 -45.65 93.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.995 -1.066 . . . . 0.01 109.819 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.5 tp -60.11 -48.5 81.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.179 -0.951 . . . . 0.01 109.896 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.656 ' O ' HD21 ' A' ' 27' ' ' LEU . 6.6 tt -78.83 -16.54 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.1 -1.0 . . . . 0.01 110.254 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -92.28 -4.98 53.21 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.607 -1.308 . . . . 0.01 111.134 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -91.76 143.13 26.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.704 -1.247 . . . . 0.01 109.751 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -59.84 -39.6 85.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.425 -0.797 . . . . 0.01 109.511 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 22.4 t -83.62 -35.6 24.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.015 -1.053 . . . . 0.01 108.335 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.76 -43.03 98.24 Favored Glycine 0 N--CA 1.483 1.767 0 N-CA-C 107.398 -2.281 . . . . 0.01 107.398 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 21' ' ' ILE . 47.5 mt -59.94 -51.73 68.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -1.118 . . . . 0.01 108.667 178.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.97 88.06 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.444 -0.785 . . . . 0.01 109.125 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.24 79.27 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.305 -0.872 . . . . 0.01 108.788 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.553 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 58.7 t80 -63.16 -46.62 86.34 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.285 -0.884 . . . . 0.0 109.37 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -60.2 -39.99 88.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.019 -1.051 . . . . 0.01 108.66 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.21 -39.94 86.36 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.267 -1.012 . . . . 0.01 108.267 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.07 -40.77 90.68 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.237 -0.914 . . . . 0.01 109.726 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' O ' ' N ' ' A' ' 38' ' ' TYR . 97.4 mt -60.15 -39.95 88.16 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.083 -1.011 . . . . 0.0 108.663 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.04 -36.41 77.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.9 m -61.03 -39.58 90.33 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.392 -0.817 . . . . 0.0 108.951 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -99.65 4.72 45.78 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' A' ' 34' ' ' LEU . 97.8 m-85 54.78 38.78 30.78 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.636 0.731 . . . . 0.01 110.088 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 p -108.58 27.49 9.34 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -65.22 -19.42 65.96 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.557 -0.715 . . . . 0.0 109.619 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -62.97 -30.28 71.46 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 120.5 -1.375 . . . . 0.0 108.108 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.517 HD21 HD21 ' A' ' 82' ' ' ASN . 93.3 m-20 -61.24 -44.96 96.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.563 -0.71 . . . . 0.0 111.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.418 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -68.57 -39.75 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.529 -1.357 . . . . 0.0 108.879 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -60.41 -42.17 95.42 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.07 -41.54 97.3 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 43.1 t90 -59.97 -44.8 94.23 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.884 -0.784 . . . . 0.01 108.884 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.75 -41.32 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.166 -0.958 . . . . 0.0 108.537 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 88.1 p -66.47 -38.1 86.57 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.6 t -65.19 -39.76 93.3 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.527 -0.733 . . . . 0.01 109.471 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 45.2 mt-10 -60.02 -46.69 88.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.049 -1.032 . . . . 0.01 109.192 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.98 -40.1 88.0 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -64.59 -39.98 94.71 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HA ' HD11 ' A' ' 100' ' ' ILE . 54.1 mtpt -70.02 -21.13 63.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.418 -0.801 . . . . 0.01 110.742 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -86.09 -34.33 20.69 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.871 -1.143 . . . . 0.01 109.289 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -70.86 115.46 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.164 -0.96 . . . . 0.01 108.562 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -100.83 0.87 39.44 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.902 . . . . 0.01 110.554 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.0 m -91.33 112.85 56.2 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.159 -0.963 . . . . 0.01 108.707 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -65.18 -9.62 22.6 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 CA-C-N 120.322 1.151 . . . . 0.01 112.305 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.1 p -82.88 -21.03 34.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.01 109.344 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -95.43 -21.07 18.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.343 -0.848 . . . . 0.01 109.934 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 72.7 mt -65.39 -40.05 92.98 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.079 -1.013 . . . . 0.01 110.081 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.425 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.38 -63.27 2.1 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.01 110.67 -179.311 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.3 Cg_exo -43.83 -58.37 1.47 Allowed 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 120.774 0.983 . . . . 0.01 113.171 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.12 -31.82 68.23 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.961 -1.087 . . . . 0.01 110.299 -178.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.89 75.46 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.937 -1.102 . . . . 0.01 108.716 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -60.71 -44.68 96.29 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.476 -0.765 . . . . 0.01 109.462 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.62 -49.84 73.6 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.294 -0.879 . . . . 0.01 109.357 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.8 mt -67.09 -46.67 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.01 108.903 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE1' HG21 ' A' ' 73' ' ' ILE . 58.7 t80 -59.95 -49.59 77.08 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.621 0.724 . . . . 0.01 109.196 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -62.74 -39.94 95.68 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.342 -0.849 . . . . 0.01 109.675 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -76.31 -59.28 2.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.673 -1.267 . . . . 0.0 111.8 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -86.31 -31.43 21.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.985 -1.072 . . . . 0.0 113.686 -176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.7 mm -100.28 -10.48 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 120.474 -1.391 . . . . 0.01 112.791 -177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -59.88 133.11 55.79 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 119.834 -1.791 . . . . 0.01 109.119 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' VAL . 2.9 m -59.98 -20.46 19.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 O-C-N 121.434 -0.791 . . . . 0.01 109.757 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -97.36 -1.24 44.93 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.012 -1.055 . . . . 0.01 109.428 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.02 140.31 31.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.01 109.609 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 80.4 p -70.55 -37.21 74.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -0.939 . . . . 0.01 109.841 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.1 pttt -109.5 63.0 0.6 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.01 109.984 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 140.05 56.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.78 -1.2 . . . . 0.01 109.605 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -84.89 141.98 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.517 HD21 HD21 ' A' ' 42' ' ' ASN . 4.5 p30 -73.34 111.83 8.83 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.259 -0.9 . . . . 0.0 109.523 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt -144.54 169.71 17.44 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.835 -1.172 . . . . 0.01 107.835 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.478 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 54.8 p30 -71.16 168.74 16.57 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.904 -1.123 . . . . 0.01 108.666 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.478 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 58.2 m -69.97 -21.36 63.25 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.274 -0.891 . . . . 0.01 111.493 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 26.0 p -91.93 -30.9 15.87 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.726 -1.234 . . . . 0.01 112.179 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.478 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.1 -40.38 89.43 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.613 -1.305 . . . . 0.01 111.868 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -60.23 -41.5 93.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.582 -1.324 . . . . 0.01 109.344 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.489 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 56.8 mp0 -60.78 -39.67 89.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.01 109.097 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.92 -43.82 86.5 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.453 -0.779 . . . . 0.01 109.754 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 16.2 m -64.85 -40.28 94.89 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.844 -1.16 . . . . 0.01 108.208 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 53.3 p -62.95 -40.01 96.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.01 108.82 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.432 HH11 ' HG3' ' A' ' 93' ' ' ARG . 20.1 mmm-85 -65.48 -33.16 75.29 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.519 -0.738 . . . . 0.01 109.213 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.535 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 28.0 m120 -61.78 -16.55 50.64 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.01 109.173 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.3 mmt -60.07 -40.06 88.19 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.592 ' N ' HD12 ' A' ' 96' ' ' LEU . 8.3 mp -65.19 -39.43 92.85 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -140.26 77.48 24.62 Favored Pre-proline 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.761 . . . . 0.01 109.334 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -61.29 120.07 7.56 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 C-N-CA 121.02 1.146 . . . . 0.01 112.139 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.0 p -126.08 171.62 10.68 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.516 -0.74 . . . . 0.01 109.058 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.475 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.4 tp -70.41 -17.79 20.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.258 -0.902 . . . . 0.01 108.946 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -90.38 1.27 56.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.332 -0.855 . . . . 0.01 109.857 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 6.7 t -60.74 -48.96 79.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.422 -0.799 . . . . 0.01 110.536 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -93.96 -5.26 48.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.931 -1.106 . . . . 0.01 110.678 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -66.59 -39.92 88.63 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.72 -1.238 . . . . 0.01 108.675 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.34 -40.0 94.92 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.36 -0.838 . . . . 0.01 108.795 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.01 -41.9 70.28 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.329 -0.857 . . . . 0.0 108.87 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -59.99 -40.5 89.39 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.96 -40.06 87.78 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.817 -0.808 . . . . 0.01 108.817 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -66.58 -39.77 88.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.403 -0.81 . . . . 0.01 108.939 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.55 -44.0 98.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 120.809 -1.182 . . . . 0.0 107.892 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.657 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.03 -51.58 69.05 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -62.54 -39.98 95.34 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.692 -0.63 . . . . 0.01 109.817 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.91 -58.37 8.85 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.005 -1.06 . . . . 0.0 110.357 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.925 ' SD ' HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -70.01 -36.22 74.96 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.873 -1.142 . . . . 0.0 110.238 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 114' ' ' MET . 88.2 tt0 -61.97 -40.01 94.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.933 -1.104 . . . . 0.01 109.766 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -70.32 -37.83 74.8 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.84 -1.163 . . . . 0.01 111.155 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.61 -49.3 3.0 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.257 -0.902 . . . . 0.0 112.429 -177.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.2 p -61.04 -44.48 97.33 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.481 -1.387 . . . . 0.01 111.058 -177.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.648 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.88 -49.83 76.15 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.158 -0.964 . . . . 0.01 109.766 -179.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.516 ' HG2' HH11 ' A' ' 120' ' ' ARG . 22.5 mtt-85 -59.86 -40.62 89.2 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.254 -1.017 . . . . 0.01 108.254 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.58 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.9 mmt180 -70.67 -39.51 73.51 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.596 -0.69 . . . . 0.01 109.193 178.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.451 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.42 -47.64 84.69 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.121 -0.987 . . . . 0.01 109.171 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.95 -35.8 75.72 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.035 -1.041 . . . . 0.01 108.344 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -99.93 9.21 43.32 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.492 -0.755 . . . . 0.01 110.348 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.58 ' N ' ' O ' ' A' ' 121' ' ' ARG . 62.3 p -78.68 158.48 28.34 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.72 -1.237 . . . . 0.01 109.455 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 18.6 ptt-85 -69.72 -38.52 76.93 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.284 -0.885 . . . . 0.01 110.207 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -59.9 -49.75 76.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.887 -1.133 . . . . 0.01 109.354 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.552 ' CZ ' HG21 ' A' ' 132' ' ' THR . 58.5 t80 -60.08 -47.42 85.95 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.577 -0.702 . . . . 0.01 109.524 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.483 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 67.6 mt -60.04 -40.14 88.37 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.273 -0.892 . . . . 0.01 109.108 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.411 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 72.7 m-20 -59.99 -44.92 94.19 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.864 -1.162 . . . . 3.77 107.864 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.92 -38.54 76.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.559 -0.904 . . . . 3.8700000000000001 108.559 178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.552 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 27.5 p -110.11 79.74 1.24 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.752 -0.592 . . . . 4.6299999999999999 109.516 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 10.9 m120 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.45 -0.944 . . . . 6.4800000000000004 108.45 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 109.24 -0.652 . . . . 18.699999999999999 109.24 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 88.4 p -74.4 150.33 40.06 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.176 -0.952 . . . . 15.970000000000001 109.633 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -69.96 -31.56 69.35 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.18 -0.95 . . . . 13.82 109.679 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.2 -35.25 76.03 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.826 -1.172 . . . . 15.06 110.216 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.875 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 96.2 mt-10 -73.26 -44.71 58.88 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.049 -1.032 . . . . 14.68 111.813 -178.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.662 HG21 HG22 ' A' ' 132' ' ' THR . 28.5 m -60.89 -33.59 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 120.425 -1.422 . . . . 11.69 108.467 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.4 mmtt -60.02 -34.31 73.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.093 -1.004 . . . . 10.51 109.168 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' CB ' ' NZ ' ' A' ' 12' ' ' LYS . 8.2 mtmp? -60.94 -31.18 70.73 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.904 -1.122 . . . . 10.82 108.195 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.555 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.6 m0 -55.99 -39.96 72.61 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.196 -0.94 . . . . 6.2599999999999998 108.514 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.19 -6.82 55.99 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.721 -1.237 . . . . 0.01 109.138 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -89.23 -27.77 20.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.028 -1.045 . . . . 0.01 110.396 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.7 p -174.46 146.42 1.04 Allowed 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.753 -1.217 . . . . 0.01 110.606 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.934 HD23 ' CD2' ' A' ' 111' ' ' PHE . 60.2 tp -60.07 -42.65 95.0 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.444 -0.785 . . . . 0.01 110.239 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -50.33 -46.07 55.31 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.255 -0.903 . . . . 0.01 110.163 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.12 -41.48 96.79 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.237 -0.914 . . . . 0.01 110.257 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.1 tp -60.11 -48.12 83.04 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.197 -0.94 . . . . 0.01 109.714 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.583 ' O ' HD21 ' A' ' 27' ' ' LEU . 47.0 pt -83.1 -17.9 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.912 -1.117 . . . . 0.01 111.3 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -91.98 -3.07 56.35 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.712 -1.242 . . . . 0.01 110.628 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.875 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 56.5 t-80 -94.17 142.13 27.76 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.936 -1.103 . . . . 0.01 109.755 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -59.87 -40.24 87.97 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.284 -0.885 . . . . 0.01 109.77 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 36.1 t -83.08 -34.8 26.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.215 -0.928 . . . . 0.01 108.626 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.17 98.9 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 107.863 -2.095 . . . . 0.01 107.863 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 21' ' ' ILE . 46.3 mt -60.03 -49.6 77.03 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.703 -0.881 . . . . 0.01 109.175 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.42 77.71 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.36 -0.837 . . . . 0.01 109.128 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.61 73.33 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.382 -0.824 . . . . 0.01 109.081 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 82.7 t80 -59.86 -50.22 74.65 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.422 -0.799 . . . . 0.0 109.568 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -63.03 -50.58 70.1 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.397 -0.815 . . . . 0.01 110.013 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.85 -41.1 71.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.108 -0.995 . . . . 0.01 111.557 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -59.93 -45.96 90.91 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.916 -1.115 . . . . 0.01 110.54 -178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.556 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 86.8 mt -65.08 -38.14 89.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.969 -1.082 . . . . 0.0 109.89 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -54.31 -37.9 65.35 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.762 -1.211 . . . . 0.01 107.81 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.1 m -64.28 -24.07 67.53 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.8 mt-10 -103.83 7.52 37.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.824 -0.806 . . . . 0.01 108.824 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 55.89 35.49 25.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.664 -0.648 . . . . 0.01 110.095 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.483 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -110.05 20.85 17.48 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.1 pm0 -61.61 -14.97 35.06 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.952 -1.093 . . . . 0.0 110.163 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -60.71 -33.82 73.45 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 120.867 -1.146 . . . . 0.0 108.8 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.56 -44.29 96.33 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.467 -0.77 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.9 tp -69.56 -38.95 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.774 -1.204 . . . . 0.0 109.537 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.52 -44.4 96.08 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.931 -1.106 . . . . 0.0 108.129 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 55.8 t80 -67.33 -40.99 85.96 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.498 ' CD1' ' NE2' ' A' ' 107' ' ' GLN . 63.4 t90 -60.32 -44.15 95.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.547 -0.721 . . . . 0.01 109.6 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -60.03 -42.5 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 121.241 -0.912 . . . . 0.0 109.087 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 83.9 p -68.65 -39.92 80.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 26.2 m -67.66 -42.3 82.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.01 110.473 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -58.73 -48.43 81.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.998 -1.063 . . . . 0.01 108.359 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.26 -38.97 85.15 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.079 -1.452 . . . . 0.01 107.079 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -63.09 -40.79 98.67 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.233 -0.655 . . . . 0.01 109.233 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.7 mttm -69.98 -24.38 63.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.3 -0.875 . . . . 0.01 109.511 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -85.28 -38.77 18.49 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.665 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 84.1 mt -69.83 102.17 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.008 -1.108 . . . . 0.01 108.008 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HA ' HD13 ' A' ' 100' ' ' ILE . 94.2 mttt -95.01 5.35 52.17 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.403 -0.811 . . . . 0.01 110.525 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.9 m -87.7 114.8 60.64 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.059 -1.025 . . . . 0.01 108.82 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -71.23 -7.43 21.33 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 CA-C-N 120.183 1.101 . . . . 0.01 112.956 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -85.8 -25.67 26.2 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.031 -1.043 . . . . 0.01 110.527 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -92.16 -12.77 31.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.778 -1.201 . . . . 0.01 110.459 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 62.4 mt -64.82 -40.59 95.45 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.056 . . . . 0.01 110.684 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.55 -63.08 2.5 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.01 111.302 -179.028 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.0 Cg_exo -41.61 -61.86 0.46 Allowed 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 120.789 0.993 . . . . 0.01 113.489 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.665 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 36.1 pttt -72.72 -26.94 61.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.96 -1.087 . . . . 0.01 110.789 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -53.44 -49.27 67.73 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.772 -1.205 . . . . 0.01 108.432 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.07 -41.29 98.0 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.361 -0.837 . . . . 0.01 108.939 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -65.43 -47.04 77.59 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.233 -0.917 . . . . 0.01 108.895 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 94.3 mt -70.0 -42.64 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.296 -0.877 . . . . 0.01 109.173 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.517 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.6 t80 -60.11 -49.48 77.46 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.677 -0.86 . . . . 0.01 108.677 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.437 ' O ' ' OG ' ' A' ' 74' ' ' SER . 95.8 m-20 -67.09 -36.33 81.73 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.546 -0.721 . . . . 0.01 110.656 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -74.66 -30.47 61.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.176 -0.952 . . . . 0.0 112.403 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.72 -19.24 2.99 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.706 -1.246 . . . . 0.0 112.996 -177.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.517 HG21 ' CE2' ' A' ' 69' ' ' TYR . 46.7 mm -103.34 -34.34 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.499 -1.376 . . . . 0.01 112.043 -177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 10.8 p -59.59 134.62 57.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.404 -1.435 . . . . 0.01 109.444 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.11 -10.8 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.501 -0.926 . . . . 0.01 108.501 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -95.46 -1.78 50.11 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.937 -0.764 . . . . 0.01 108.937 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.36 142.21 22.24 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.39 -0.819 . . . . 0.01 109.333 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.6 p -69.88 -19.73 63.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.186 -0.946 . . . . 0.01 109.206 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.2 pttm -140.61 86.94 2.09 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.427 -0.796 . . . . 0.01 109.066 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.79 140.27 56.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.433 -0.792 . . . . 0.01 109.397 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.3 m -92.47 160.17 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.288 -0.882 . . . . 0.0 109.21 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.458 ' N ' ' OD1' ' A' ' 82' ' ' ASN . 13.5 p-10 -75.71 102.35 5.36 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.362 -0.836 . . . . 0.0 109.715 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.2 mt -146.01 156.71 43.67 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.63 -0.878 . . . . 0.01 108.63 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 87' ' ' THR . 42.2 p-10 -76.03 170.14 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.138 -0.976 . . . . 0.01 109.325 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 t -69.82 -20.74 63.43 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.316 -0.865 . . . . 0.01 110.217 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 14.2 m -81.37 -45.31 16.31 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.759 -1.213 . . . . 0.01 110.198 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.467 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 63.7 m -60.36 -47.86 84.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.01 109.739 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -60.07 -48.31 82.26 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.1 -1.0 . . . . 0.01 108.919 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -62.24 -38.13 88.03 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.347 -0.845 . . . . 0.01 109.578 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 87.3 tt0 -59.38 -40.02 85.18 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.055 -1.028 . . . . 0.01 109.118 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.5 m -63.45 -40.61 97.61 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.896 -1.128 . . . . 0.01 108.248 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.7 p -60.04 -38.37 82.57 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.945 -0.761 . . . . 0.01 108.945 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.483 ' HG2' HH11 ' A' ' 93' ' ' ARG . 28.3 mtt-85 -69.07 -36.55 77.75 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.331 -0.856 . . . . 0.01 109.647 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.418 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 97.8 m-20 -65.3 -18.98 65.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.317 -0.864 . . . . 0.01 110.284 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.4 mmm -59.95 -36.08 76.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.972 -1.08 . . . . 0.01 109.033 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.603 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.9 mp -68.71 -30.15 68.73 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 107.865 -1.161 . . . . 0.01 107.865 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.0 mt-10 -141.87 75.49 21.08 Favored Pre-proline 0 N--CA 1.492 1.667 0 N-CA-C 108.512 -0.922 . . . . 0.01 108.512 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -63.79 127.61 20.03 Favored 'Trans proline' 0 C--N 1.313 -1.329 0 C-N-CA 121.066 1.177 . . . . 0.01 111.953 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.7 p -129.54 170.01 14.28 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 109.249 -0.649 . . . . 0.01 109.249 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 56' ' ' LYS . 10.7 tp -70.45 -20.02 22.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.336 -0.852 . . . . 0.01 109.431 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.1 p -93.91 3.66 55.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.188 -0.945 . . . . 0.01 109.604 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.418 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.9 t -59.04 -53.93 52.87 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.328 -0.857 . . . . 0.01 110.535 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.28 -6.67 43.95 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.083 -1.011 . . . . 0.01 111.056 -178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 88.4 m-20 -60.94 -40.03 91.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.626 -1.296 . . . . 0.01 109.014 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -65.94 -38.3 88.28 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.415 -0.803 . . . . 0.01 108.944 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.79 62.29 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.38 -0.825 . . . . 0.0 110.344 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.498 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 50.5 tt0 -60.1 -39.87 87.68 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.927 -1.108 . . . . 0.0 108.577 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -59.65 -40.04 86.38 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -63.98 -37.69 88.34 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.236 -0.915 . . . . 0.01 108.593 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.56 -39.94 85.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.316 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.934 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.1 m-85 -51.5 -55.17 20.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.324 -0.86 . . . . 0.0 108.763 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -60.06 -39.83 87.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.01 110.2 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.25 -63.29 1.36 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.134 -0.979 . . . . 0.0 110.412 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.581 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.0 ptt? -69.67 -39.27 77.1 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.019 -1.051 . . . . 0.0 110.151 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.55 ' HB2' HD22 ' A' ' 17' ' ' LEU . 87.0 tt0 -55.52 -59.9 4.18 Favored 'General case' 0 C--O 1.199 -1.569 0 O-C-N 120.492 -1.38 . . . . 0.01 109.059 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -69.93 -40.03 75.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.01 110.685 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -73.23 -50.3 23.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.091 -1.005 . . . . 0.0 110.337 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.581 ' N ' ' O ' ' A' ' 114' ' ' MET . 18.5 p -68.8 -44.03 74.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.042 -1.037 . . . . 0.01 111.113 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.555 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 3.1 m-85 -56.69 -54.32 47.54 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.663 -1.273 . . . . 0.01 110.191 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.23 -39.94 84.3 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.133 -1.027 . . . . 0.01 108.245 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.548 HH11 ' HG2' ' A' ' 121' ' ' ARG . 0.2 OUTLIER -70.21 -41.25 73.9 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.032 -1.067 . . . . 0.01 108.73 178.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.0 OUTLIER -64.24 -56.52 14.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.147 -0.97 . . . . 0.01 109.8 179.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.9 mt -55.76 -23.95 32.55 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.336 -0.853 . . . . 0.01 108.91 -178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.55 -1.77 26.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.647 -0.658 . . . . 0.01 109.351 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 121' ' ' ARG . 80.1 p -77.14 159.55 29.68 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.179 -0.95 . . . . 0.01 110.086 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -69.96 -38.71 76.17 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 109.068 -0.716 . . . . 0.01 109.068 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -59.98 -47.81 84.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.401 -0.812 . . . . 0.01 110.109 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 132' ' ' THR . 54.3 t80 -59.89 -48.89 79.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.842 -1.161 . . . . 0.01 109.495 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.93 -50.87 72.08 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 120.854 -1.154 . . . . 0.01 108.981 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.5 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 91.3 m-20 -65.57 -43.18 90.59 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.099 -1.001 . . . . 3.77 110.061 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.0 -39.45 75.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.968 . . . . 3.8700000000000001 109.525 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 128' ' ' TYR . 6.8 p -103.22 74.23 1.27 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.707 0.765 . . . . 4.6299999999999999 109.44 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 2.3 m-80 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.504 -0.924 . . . . 6.4800000000000004 108.504 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.499 HG12 HD22 ' A' ' 131' ' ' LEU . 7.5 p . . . . . 0 N--CA 1.498 1.94 0 CA-C-O 121.278 0.561 . . . . 18.699999999999999 109.861 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.0 p -75.69 159.18 31.4 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.344 -0.847 . . . . 15.970000000000001 109.97 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 133' ' ' ASN . 88.8 mt-30 -64.81 -33.46 76.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.468 -0.77 . . . . 13.82 109.214 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 58.3 mp0 -66.19 -39.98 90.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.465 -0.772 . . . . 15.06 111.058 -178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.427 ' HG3' ' HE2' ' A' ' 23' ' ' HIS . 68.1 mm-40 -70.87 -40.45 72.29 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.97 -1.081 . . . . 14.68 111.444 -177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 131' ' ' LEU . 13.1 m -62.72 -36.09 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.608 -1.307 . . . . 11.69 109.362 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.93 -36.17 76.48 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.766 -1.208 . . . . 10.51 108.373 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -63.45 -35.12 79.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.027 -1.101 . . . . 10.82 108.027 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.8 m0 -58.28 -29.49 65.87 Favored 'General case' 0 C--O 1.2 -1.507 0 N-CA-C 107.69 -1.226 . . . . 6.2599999999999998 107.69 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.42 -9.23 59.52 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.56 -1.338 . . . . 0.01 108.766 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -93.48 -24.04 18.16 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.403 -0.811 . . . . 0.01 110.932 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.469 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 95.3 p -172.64 143.61 1.33 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.794 -1.191 . . . . 0.01 111.153 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.844 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.97 -39.97 87.47 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.42 0.629 . . . . 0.01 109.527 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.505 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.7 mt-10 -55.47 -40.85 72.15 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.397 -0.814 . . . . 0.01 110.287 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -61.54 -46.87 88.11 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.985 -1.072 . . . . 0.01 109.501 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.2 tp -59.93 -48.87 79.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.01 108.687 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 78.2 mt -74.08 -25.47 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.541 -0.725 . . . . 0.01 110.561 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' GLU . 93.7 m-20 -89.79 0.03 57.26 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.654 -1.279 . . . . 0.01 110.464 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.427 ' HE2' ' HG3' ' A' ' 9' ' ' GLU . 48.1 t-80 -95.73 137.51 34.7 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.947 -1.096 . . . . 0.01 109.408 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -59.99 -40.08 87.93 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.401 -0.812 . . . . 0.01 109.994 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.6 t -83.39 -29.57 28.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.994 -1.066 . . . . 0.01 108.698 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.32 -48.2 85.07 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 107.193 -2.363 . . . . 0.01 107.193 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.03 -44.31 94.72 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.409 -1.054 . . . . 0.01 108.206 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.42 81.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.127 -0.983 . . . . 0.01 108.572 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.52 -40.02 77.17 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.471 -0.768 . . . . 0.01 109.368 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -69.48 -39.99 77.33 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.225 -0.922 . . . . 0.0 109.285 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -59.07 -42.76 91.14 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.944 -1.098 . . . . 0.01 108.391 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.21 -44.28 68.97 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.231 -0.918 . . . . 0.01 108.862 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -60.02 -42.44 94.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.359 -0.838 . . . . 0.01 110.19 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.508 ' O ' ' N ' ' A' ' 38' ' ' TYR . 67.6 mt -60.0 -39.92 87.43 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.935 -1.103 . . . . 0.0 108.382 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -59.82 -40.08 87.21 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.325 -0.991 . . . . 0.01 108.325 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -61.39 -34.56 75.56 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -101.36 6.66 42.75 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.978 -0.749 . . . . 0.01 108.978 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.9 m-85 50.53 36.96 14.76 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.481 -0.762 . . . . 0.01 109.687 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.435 ' OG ' HD23 ' A' ' 34' ' ' LEU . 2.9 p -104.62 28.73 6.75 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.505 -0.747 . . . . 0.0 109.102 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.8 pm0 -63.99 -19.07 64.89 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.357 -0.839 . . . . 0.0 108.834 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -61.72 -40.01 93.57 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.103 -0.998 . . . . 0.0 108.328 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -60.6 -49.92 75.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.557 -0.715 . . . . 0.0 111.157 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tp -70.23 -41.87 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.728 -1.232 . . . . 0.0 109.498 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -63.22 -41.87 99.19 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CZ ' ' SG ' ' A' ' 49' ' ' CYS . 75.0 t80 -65.28 -40.64 94.15 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.525 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 25.7 t90 -60.11 -44.14 95.09 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.536 -0.728 . . . . 0.01 109.295 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.09 -42.48 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.117 -0.989 . . . . 0.0 108.947 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.1 p -66.68 -39.85 88.31 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CZ ' ' A' ' 45' ' ' PHE . 92.3 m -66.6 -38.95 88.05 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.462 -0.774 . . . . 0.01 109.069 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -46.12 90.45 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.099 -1.0 . . . . 0.01 108.947 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -60.02 -39.96 87.68 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.792 -1.193 . . . . 0.01 107.942 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -64.48 -42.56 95.82 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.506 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 21.3 mttm -71.87 -20.47 61.79 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.661 -0.649 . . . . 0.01 111.976 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -84.11 -22.66 31.03 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.558 -1.339 . . . . 0.01 108.792 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.5 mt -74.92 118.02 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 N-CA-C 108.719 -0.845 . . . . 0.01 108.719 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -95.92 -0.06 51.31 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.087 -1.008 . . . . 0.01 109.677 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.4 m -95.19 111.8 56.25 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.399 -0.813 . . . . 0.01 109.331 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -70.98 0.16 6.99 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.069 1.06 . . . . 0.01 112.07 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.3 t -86.81 -28.54 22.89 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.357 -0.839 . . . . 0.01 109.896 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -91.66 -16.67 26.67 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.241 -0.912 . . . . 0.01 110.122 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 83.5 mt -62.98 -39.96 96.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.993 -1.067 . . . . 0.01 109.515 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.62 -64.19 1.45 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.413 -0.804 . . . . 0.01 111.341 -179.371 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.2 Cg_exo -43.5 -61.99 0.49 Allowed 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 120.716 0.944 . . . . 0.01 112.935 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' H ' ' HG2' ' A' ' 64' ' ' LYS . 0.6 OUTLIER -72.2 -22.66 61.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.992 -1.068 . . . . 0.01 110.785 -179.179 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.61 -49.18 78.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.443 -1.411 . . . . 0.01 108.138 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -60.56 -42.19 96.1 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.302 -0.874 . . . . 0.01 108.991 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -63.49 -49.73 72.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.332 -0.855 . . . . 0.01 109.008 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.9 mt -69.14 -43.85 81.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.263 -0.898 . . . . 0.01 108.861 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.689 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.7 t80 -60.87 -50.03 75.09 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.931 0.872 . . . . 0.01 108.917 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -60.74 -35.19 75.75 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.835 -1.166 . . . . 0.01 109.443 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 86.8 tt0 -80.09 -68.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.283 -0.885 . . . . 0.0 112.461 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -83.95 -15.92 46.07 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.584 -1.322 . . . . 0.0 114.014 -176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.689 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.0 mm -105.32 -24.25 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 O-C-N 120.353 -1.467 . . . . 0.01 111.485 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.427 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 40.7 t -57.59 123.53 15.91 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.485 -1.384 . . . . 0.01 109.595 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.4 m -61.31 -11.33 4.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 O-C-N 121.339 -0.851 . . . . 0.01 109.546 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -98.3 -14.93 19.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.252 -0.905 . . . . 0.01 109.734 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 71' ' ' GLU . . . -52.2 148.05 6.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.064 -1.023 . . . . 0.01 110.004 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.4 p -72.86 -18.38 61.44 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.528 -0.733 . . . . 0.01 110.687 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.4 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 37.6 pttt -130.6 73.14 1.52 Allowed 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.077 -1.014 . . . . 0.01 110.883 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' A' ' 74' ' ' SER . 43.5 mm-40 -79.65 160.04 26.5 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.986 -1.071 . . . . 0.01 109.453 178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.408 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 2.4 m -99.81 142.71 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.558 -0.714 . . . . 0.0 109.227 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.657 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -74.28 105.98 5.71 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.479 -0.763 . . . . 0.0 109.583 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.527 HD12 ' NH1' ' A' ' 88' ' ' ARG . 67.4 mt -146.33 174.29 11.49 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.472 -0.768 . . . . 0.01 109.199 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -69.94 153.17 43.6 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.166 -0.959 . . . . 0.01 109.303 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.6 m -70.0 -17.47 63.28 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.287 -0.883 . . . . 0.01 109.537 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 87' ' ' THR . 21.2 p -82.06 -41.36 20.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.276 -0.89 . . . . 0.01 109.613 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.535 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.4 m -60.11 -41.44 92.59 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.226 -0.921 . . . . 0.01 109.296 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.616 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 3.6 mmp_? -64.0 -52.23 60.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.305 -0.872 . . . . 0.01 109.083 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' CB ' HH22 ' A' ' 93' ' ' ARG . 99.7 mt-10 -60.02 -39.51 86.1 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' N ' ' NH2' ' A' ' 93' ' ' ARG . 80.9 tt0 -59.8 -39.04 83.62 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -59.95 -40.3 88.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.023 -1.048 . . . . 0.01 108.778 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 80.3 p -59.94 -39.97 87.35 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.161 -0.962 . . . . 0.01 108.977 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.575 HH22 ' CB ' ' A' ' 89' ' ' GLU . 31.8 mtm-85 -66.61 -40.03 88.62 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.213 -0.93 . . . . 0.01 108.745 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -61.42 -35.08 76.56 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.01 109.496 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.625 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 58.4 mtp -58.78 -32.8 69.64 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.277 -0.889 . . . . 0.01 109.445 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.88 -20.28 66.35 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 107.253 -1.388 . . . . 0.01 107.253 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -140.87 79.52 18.65 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 107.603 -1.258 . . . . 0.01 107.603 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -58.86 110.61 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.039 1.159 . . . . 0.01 112.157 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -130.99 172.34 12.18 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.552 -0.718 . . . . 0.01 109.592 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.9 tp -71.83 -12.26 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.354 -0.841 . . . . 0.01 108.886 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -94.38 0.42 55.47 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.252 -0.905 . . . . 0.01 109.563 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 18.9 t -61.06 -57.57 12.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.357 -0.84 . . . . 0.01 111.036 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.506 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 78.1 m-85 -94.81 -3.24 49.35 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.063 -1.023 . . . . 0.01 111.251 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.454 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 97.4 m-20 -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.661 -1.274 . . . . 0.01 108.914 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.402 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 98.8 mt-10 -61.43 -40.02 92.92 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.484 -0.76 . . . . 0.01 109.51 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.81 39.64 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.094 -1.004 . . . . 0.0 108.987 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.467 ' OE1' ' CD1' ' A' ' 46' ' ' TRP . 29.4 tt0 -60.08 -40.17 88.64 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.169 -0.957 . . . . 0.0 109.528 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -59.96 -43.36 95.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.01 108.679 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.535 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.7 mmtp -67.81 -38.56 83.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.376 -0.827 . . . . 0.01 109.244 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.78 -43.85 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.095 -1.003 . . . . 0.0 108.811 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.844 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.1 -49.88 75.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.938 -1.101 . . . . 0.0 108.109 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -64.83 -43.73 92.1 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.074 -1.016 . . . . 0.01 109.678 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.84 -55.18 18.4 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.194 -0.941 . . . . 0.0 110.617 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.584 ' SD ' HD21 ' A' ' 17' ' ' LEU . 14.3 ptm -61.13 -35.06 76.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.092 -1.005 . . . . 0.0 109.709 -178.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 17' ' ' LEU . 82.6 mt-10 -64.57 -47.67 77.84 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.915 -1.116 . . . . 0.01 109.634 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.03 -36.48 75.08 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.148 -1.595 . . . . 0.01 109.76 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -84.11 -46.08 12.32 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.151 -0.968 . . . . 0.0 111.483 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.495 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.1 p -88.95 -58.5 2.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.806 -1.184 . . . . 0.01 113.465 -177.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -47.24 -50.67 20.7 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.399 -1.438 . . . . 0.01 110.842 -177.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.03 -43.43 95.29 Favored 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.884 -1.135 . . . . 0.01 109.003 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.543 ' O ' ' N ' ' A' ' 125' ' ' SER . 54.8 mtt-85 -71.47 -40.02 70.54 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.216 -0.927 . . . . 0.01 108.91 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.5 -49.84 75.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.286 -0.884 . . . . 0.01 109.085 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.99 -40.01 87.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.385 -0.822 . . . . 0.01 108.802 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -83.43 -12.57 56.24 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.627 -0.671 . . . . 0.01 109.935 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.543 ' N ' ' O ' ' A' ' 121' ' ' ARG . 58.2 m -70.2 150.41 46.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.112 -0.993 . . . . 0.01 110.255 -179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -59.95 -34.85 73.82 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.779 -0.576 . . . . 0.01 110.061 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -59.93 -50.07 75.21 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.958 -1.089 . . . . 0.01 110.761 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.688 ' CZ ' HG21 ' A' ' 132' ' ' THR . 88.5 t80 -60.07 -49.36 77.96 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.503 -1.373 . . . . 0.01 109.319 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.9 mt -60.0 -51.19 70.73 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.318 -0.864 . . . . 0.01 109.469 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -62.51 -43.7 98.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.171 -0.955 . . . . 3.77 109.941 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.499 HD22 HG12 ' A' ' 5' ' ' VAL . 89.4 mt -69.96 -27.23 64.57 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.296 -0.877 . . . . 3.8700000000000001 109.078 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.688 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 82.0 p -97.29 63.35 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.293 -0.879 . . . . 4.6299999999999999 110.004 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.418 ' HB2' HE21 ' A' ' 7' ' ' GLN . 61.5 m-20 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 107.863 -1.162 . . . . 6.4800000000000004 107.863 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.464 ' HB ' HD22 ' A' ' 131' ' ' LEU . 58.5 t . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 121.347 0.594 . . . . 18.699999999999999 109.636 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -72.07 159.94 33.31 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.4 -0.813 . . . . 15.970000000000001 108.845 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -67.27 -25.61 66.14 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.98 -1.075 . . . . 13.82 109.276 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -65.02 -37.88 89.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.213 -0.929 . . . . 15.06 110.584 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -70.37 -46.7 63.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.98 -1.075 . . . . 14.68 111.235 -177.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.405 HG21 ' CG2' ' A' ' 132' ' ' THR . 15.8 m -61.18 -40.32 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 120.715 -1.241 . . . . 11.69 109.397 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -59.99 -39.69 86.59 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.749 -1.22 . . . . 10.51 108.455 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -64.77 -33.89 77.05 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 108.686 -0.857 . . . . 10.82 108.686 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.526 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 43.0 m0 -59.9 -32.36 70.68 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.239 -1.023 . . . . 6.2599999999999998 108.239 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.09 -8.19 59.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.013 -1.054 . . . . 0.01 110.156 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -87.16 -30.76 20.8 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.865 -1.147 . . . . 0.01 110.943 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.479 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 20.6 p -172.68 147.65 1.81 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.663 -1.273 . . . . 0.01 110.83 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.6 tp -59.8 -39.85 86.37 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.813 -0.554 . . . . 0.01 110.159 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.23 -40.05 70.41 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.156 -0.965 . . . . 0.01 109.948 -179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -61.4 -48.91 79.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.097 -1.002 . . . . 0.01 110.177 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 tp -60.78 -43.09 98.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.13 -0.981 . . . . 0.01 109.126 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 68.1 mt -77.47 -25.69 15.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.326 -0.859 . . . . 0.01 109.961 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.458 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.9 m-20 -89.68 -0.91 57.83 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.828 -1.17 . . . . 0.01 110.306 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -95.29 134.85 37.6 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.094 -1.004 . . . . 0.01 109.103 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -60.06 -40.75 90.54 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.286 -0.884 . . . . 0.01 110.718 -178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.94 -25.7 32.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.744 -1.223 . . . . 0.01 108.357 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.59 -46.43 93.76 Favored Glycine 0 N--CA 1.484 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.01 107.463 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.07 -46.03 90.92 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.594 -0.945 . . . . 0.01 108.799 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.56 -50.23 73.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.088 -1.008 . . . . 0.01 109.474 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.14 -47.0 69.27 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.431 -0.793 . . . . 0.01 109.581 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.742 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.0 t80 -60.37 -47.7 84.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.306 -0.871 . . . . 0.0 110.358 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.414 ' CB ' ' NZ ' ' A' ' 31' ' ' LYS . 8.4 mtpm? -59.74 -40.04 86.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.983 -1.073 . . . . 0.01 109.671 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.03 -39.5 75.73 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.019 -1.051 . . . . 0.01 108.513 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -60.08 -40.59 90.07 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.423 -0.798 . . . . 0.01 109.355 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' A' ' 30' ' ' PHE . 91.2 mt -61.59 -39.96 93.09 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.132 -0.98 . . . . 0.0 108.617 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.0 -39.91 87.41 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.255 -1.017 . . . . 0.01 108.255 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -60.02 -38.52 82.91 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.385 -0.822 . . . . 0.0 109.037 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.86 4.95 45.42 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.22 -0.925 . . . . 0.01 109.265 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.506 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.3 m-85 56.83 29.93 16.93 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.617 -0.677 . . . . 0.01 109.791 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 t -101.13 28.96 4.95 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -66.6 -14.08 61.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.531 -0.731 . . . . 0.0 109.505 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.526 ' OE2' ' N ' ' A' ' 82' ' ' ASN . 19.1 pt-20 -63.16 -35.91 81.86 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.89 -1.131 . . . . 0.0 108.545 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.483 HD21 HD21 ' A' ' 82' ' ' ASN . 98.4 m-20 -60.28 -52.9 63.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.435 -0.791 . . . . 0.0 110.918 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.16 -39.89 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 120.863 -1.148 . . . . 0.0 109.905 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.43 -45.16 94.65 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.015 -1.053 . . . . 0.0 108.605 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -64.33 -38.91 92.72 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -60.03 -45.21 93.54 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.11 -0.7 . . . . 0.01 109.11 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.1 mt -60.17 -45.65 95.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.1 -1.0 . . . . 0.0 108.89 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.8 p -68.98 -40.01 79.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.139 -0.975 . . . . 0.0 108.439 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 t -65.71 -37.81 87.47 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.409 -0.807 . . . . 0.01 109.076 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -60.01 -39.99 87.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.298 -0.876 . . . . 0.01 108.675 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.01 -40.63 89.92 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 107.879 -1.156 . . . . 0.01 107.879 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.441 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 30.7 t80 -64.62 -39.84 94.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.413 ' CE ' ' OE1' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -67.07 -23.07 65.82 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.971 -0.455 . . . . 0.01 110.813 -179.115 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -85.14 -31.43 23.3 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.892 -1.13 . . . . 0.01 110.064 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 64.5 mt -72.3 117.87 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.103 -0.998 . . . . 0.01 108.93 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -98.69 0.11 43.97 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.324 -0.86 . . . . 0.01 109.622 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.5 m -93.57 111.91 54.46 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.378 -0.827 . . . . 0.01 109.199 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.99 -0.66 6.59 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.219 1.114 . . . . 0.01 112.642 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.1 t -87.64 -29.62 21.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.011 -1.055 . . . . 0.01 110.118 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -90.39 -15.94 30.04 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.973 -1.079 . . . . 0.01 109.969 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.441 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 79.9 mt -61.88 -40.08 94.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.041 -1.037 . . . . 0.01 109.083 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -49.47 -64.51 1.17 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.24 -0.913 . . . . 0.01 111.055 -179.061 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.1 Cg_exo -43.7 -60.9 0.66 Allowed 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 120.579 0.853 . . . . 0.01 113.083 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.78 -25.88 61.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.01 110.841 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -57.46 -48.44 79.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.658 -1.277 . . . . 0.01 108.672 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.08 -42.46 99.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.569 -0.707 . . . . 0.01 109.47 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.24 -51.21 68.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.297 -0.877 . . . . 0.01 109.203 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.3 mt -60.74 -50.0 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.223 -1.028 . . . . 0.01 108.223 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.59 ' CG ' ' SD ' ' A' ' 95' ' ' MET . 59.4 t80 -60.0 -50.0 75.47 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.625 0.726 . . . . 0.01 109.475 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.73 -40.06 96.02 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.753 0.787 . . . . 0.01 109.33 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -77.17 -60.52 2.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.118 -0.989 . . . . 0.0 111.582 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -85.76 -32.15 22.0 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.9 mm -98.69 -12.18 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 120.256 -1.527 . . . . 0.01 112.56 -176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.1 p -60.07 132.65 54.6 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.085 -1.634 . . . . 0.01 108.934 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.408 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 32.7 m -60.43 -14.74 9.12 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.212 -1.033 . . . . 0.01 108.212 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -100.0 3.03 43.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.498 -0.751 . . . . 0.01 109.205 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -48.87 143.17 5.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.424 -0.798 . . . . 0.01 110.012 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.4 p -69.92 -21.82 63.26 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.571 -0.9 . . . . 0.01 108.571 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -138.56 82.65 1.92 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.59 -0.893 . . . . 0.01 108.59 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -63.65 143.71 57.61 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.244 -0.91 . . . . 0.01 109.636 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 81' ' ' VAL . 2.8 m -91.34 144.53 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.526 ' N ' ' OE2' ' A' ' 41' ' ' GLU . 6.7 p30 -74.09 98.07 3.03 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.077 -1.015 . . . . 0.0 109.457 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.6 mt -141.89 160.64 39.79 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.016 -0.735 . . . . 0.01 109.016 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -70.67 160.39 32.69 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.292 -0.88 . . . . 0.01 109.003 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 76.9 p -69.43 -17.69 63.67 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.211 -0.93 . . . . 0.01 109.487 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.7 t -80.96 -45.65 16.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.923 -1.111 . . . . 0.01 109.603 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.541 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.3 m -60.08 -45.15 93.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.057 -1.027 . . . . 0.01 109.555 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -60.36 -50.3 74.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.069 -1.02 . . . . 0.01 108.603 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -60.01 -40.05 87.89 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.6 -0.889 . . . . 0.01 108.6 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -59.02 -39.85 83.17 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.49 -0.756 . . . . 0.01 109.134 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.3 m -60.11 -42.56 94.98 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 120.966 -1.084 . . . . 0.01 108.195 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p -60.23 -40.02 88.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.287 -0.883 . . . . 0.01 109.147 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.534 ' HG2' HH11 ' A' ' 93' ' ' ARG . 20.1 mtt-85 -64.32 -42.76 96.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.055 -1.028 . . . . 0.01 108.812 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.84 -35.37 80.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.606 -0.684 . . . . 0.01 109.187 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.59 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 82.6 mtp -57.46 -32.62 67.13 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.328 -0.857 . . . . 0.01 108.809 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.3 -20.58 66.18 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.728 -1.212 . . . . 0.01 107.728 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -138.37 80.06 28.79 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 107.607 -1.257 . . . . 0.01 107.607 179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -54.74 106.94 0.19 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 C-N-CA 120.963 1.109 . . . . 0.01 112.527 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.7 p -129.97 169.43 15.25 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.91 -0.774 . . . . 0.01 108.91 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 tp -72.1 -20.51 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.01 109.571 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.0 p -92.12 9.37 33.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.209 -0.932 . . . . 0.01 109.288 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.571 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -63.65 -61.46 2.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.536 -0.728 . . . . 0.01 110.696 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.571 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 61.6 m-85 -94.97 -1.66 52.02 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.175 -0.953 . . . . 0.01 110.962 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.715 -1.24 . . . . 0.01 108.833 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.92 -39.46 94.65 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.473 -0.767 . . . . 0.01 108.991 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.86 -41.24 83.17 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.083 -1.01 . . . . 0.0 109.078 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 55.8 tt0 -59.98 -44.06 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.051 -1.03 . . . . 0.0 108.695 179.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -60.04 -40.29 88.88 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.079 -0.711 . . . . 0.01 109.079 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.541 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.5 mmtp -63.29 -39.89 95.84 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.557 -0.905 . . . . 0.01 108.557 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.2 mm -63.99 -43.87 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.545 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -59.98 -48.29 82.31 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -66.17 -48.47 70.6 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.448 -0.782 . . . . 0.01 109.595 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 59.1 tp -60.18 -52.18 66.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.996 -1.065 . . . . 0.0 111.387 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.519 ' SD ' HD21 ' A' ' 17' ' ' LEU . 11.0 ptm -65.59 -40.33 92.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.754 -1.216 . . . . 0.0 110.055 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.5 -40.07 85.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.081 -1.012 . . . . 0.01 111.093 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -70.07 -30.06 67.21 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 120.093 -1.629 . . . . 0.01 111.365 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.554 ' OD1' ' N ' ' A' ' 118' ' ' SER . 31.9 p-10 -113.97 -32.89 5.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.142 -0.974 . . . . 0.0 112.384 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -81.08 -47.45 13.52 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.064 -1.647 . . . . 0.01 110.982 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.526 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -55.41 -45.2 76.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.435 -0.79 . . . . 0.01 111.173 -178.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.495 ' HG2' HH11 ' A' ' 120' ' ' ARG . 10.1 mmt-85 -59.88 -48.16 82.84 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.815 -1.178 . . . . 0.01 109.058 -178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.594 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.1 OUTLIER -70.65 -30.3 66.87 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.803 -1.186 . . . . 0.01 108.943 178.662 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -59.63 -48.47 81.54 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.856 -1.152 . . . . 0.01 108.908 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.93 -37.9 80.83 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.913 -1.143 . . . . 0.01 107.913 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -90.68 -1.53 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.328 -0.858 . . . . 0.01 110.627 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.594 ' N ' ' O ' ' A' ' 121' ' ' ARG . 84.9 p -72.14 159.37 34.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.782 -1.199 . . . . 0.01 109.829 -178.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 130' ' ' ASP . 19.5 mmm180 -62.08 -38.01 87.21 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.536 -0.727 . . . . 0.01 109.192 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -59.13 -50.34 74.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.091 -1.006 . . . . 0.01 110.133 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.418 ' O ' ' OG1' ' A' ' 132' ' ' THR . 54.0 t80 -67.9 -49.49 61.62 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.977 -1.077 . . . . 0.01 109.147 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.63 -42.6 97.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.53 -0.731 . . . . 0.01 109.551 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.506 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.7 m-20 -59.86 -46.64 88.64 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.335 -0.946 . . . . 3.77 108.46 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.464 HD22 ' HB ' ' A' ' 5' ' ' VAL . 92.6 mt -70.51 -40.98 73.19 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.697 -0.853 . . . . 3.8700000000000001 108.697 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 80.4 p -110.93 80.91 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.122 -1.066 . . . . 4.6299999999999999 108.122 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.506 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 5.5 m120 . . . . . 0 C--N 1.295 -1.782 0 C-N-CA 119.603 -0.839 . . . . 6.4800000000000004 109.357 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 108.591 -0.892 . . . . 18.699999999999999 108.591 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 p -72.13 141.58 49.15 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.112 -0.993 . . . . 15.970000000000001 109.49 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 131' ' ' LEU . 98.7 mm-40 -68.12 -23.84 64.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.463 -0.773 . . . . 13.82 109.159 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -67.11 -39.86 86.76 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.974 -1.079 . . . . 15.06 109.407 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 75.1 mm-40 -75.22 -40.75 58.83 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.484 -0.76 . . . . 14.68 112.424 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 132' ' ' THR . 5.3 m -60.62 -38.94 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 120.364 -1.46 . . . . 11.69 110.123 -178.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' HG23 ' A' ' 10' ' ' VAL . 33.7 mtmm -59.89 -32.92 71.18 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.899 -1.125 . . . . 10.51 109.14 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.89 -37.67 83.01 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 107.696 -1.224 . . . . 10.82 107.696 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 38.8 m0 -57.83 -27.88 63.58 Favored 'General case' 0 C--O 1.202 -1.433 0 N-CA-C 108.61 -0.885 . . . . 6.2599999999999998 108.61 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.37 59.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.92 -1.113 . . . . 0.01 108.927 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -92.83 -35.55 13.33 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.527 -0.733 . . . . 0.01 110.978 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 24.2 p -171.63 149.09 2.55 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.589 -1.32 . . . . 0.01 110.733 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.5 HD21 ' SD ' ' A' ' 114' ' ' MET . 42.0 tp -59.92 -40.08 87.65 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.792 -0.567 . . . . 0.01 109.803 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -48.11 -43.94 31.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.317 -0.864 . . . . 0.01 110.106 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -65.69 -42.5 91.15 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.817 -1.177 . . . . 0.01 110.292 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.7 tp -60.18 -46.46 89.63 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.984 -1.073 . . . . 0.01 110.627 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -81.34 -16.35 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 120.777 -1.202 . . . . 0.01 110.798 -178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -91.1 -10.98 39.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.806 -1.184 . . . . 0.01 110.692 -178.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.441 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 24.0 t-80 -92.46 142.34 27.53 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.89 -1.132 . . . . 0.01 110.343 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -59.91 -40.02 87.39 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.746 -0.596 . . . . 0.01 109.664 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.0 t -83.55 -31.81 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.027 -1.046 . . . . 0.01 108.475 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.73 -50.56 66.1 Favored Glycine 0 N--CA 1.482 1.74 0 N-CA-C 107.739 -2.145 . . . . 0.01 107.739 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 38.6 mt -60.01 -45.56 92.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.41 -1.053 . . . . 0.01 108.858 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.69 76.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.439 -0.788 . . . . 0.01 109.062 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.01 -47.64 64.99 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.754 -0.832 . . . . 0.01 108.754 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.792 ' CE2' HD11 ' A' ' 34' ' ' LEU . 53.5 t80 -60.41 -50.05 75.12 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.384 -0.822 . . . . 0.0 110.348 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -60.29 -40.02 88.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.876 -1.14 . . . . 0.01 109.47 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.45 87.62 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.11 -1.07 . . . . 0.01 108.11 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.478 ' CZ ' ' OG ' ' A' ' 125' ' ' SER . 20.0 t80 -62.44 -40.54 96.91 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.395 -0.816 . . . . 0.01 109.388 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.792 HD11 ' CE2' ' A' ' 30' ' ' PHE . 60.1 mt -60.09 -39.59 86.68 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.981 -1.074 . . . . 0.0 108.197 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -59.45 -39.98 85.34 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.219 -1.03 . . . . 0.01 108.219 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -60.14 -34.51 73.63 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -98.96 3.42 47.03 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.8 m-85 54.89 35.6 24.74 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.803 -0.561 . . . . 0.01 110.203 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.528 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.3 OUTLIER -109.48 28.4 8.58 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.618 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.5 pm0 -61.3 -20.85 63.39 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.877 -1.139 . . . . 0.0 108.904 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.445 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.6 pt-20 -64.82 -33.95 77.21 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.764 HD21 HD21 ' A' ' 82' ' ' ASN . 97.9 m-20 -60.05 -46.4 89.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 110.436 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tp -69.28 -40.04 79.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.66 -1.275 . . . . 0.0 108.131 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.54 -40.15 93.63 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.559 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.7 t80 -63.34 -43.46 97.66 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.449 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 85.8 t90 -61.89 -41.07 97.45 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.527 -0.733 . . . . 0.01 109.994 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.12 -44.52 97.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.081 -1.012 . . . . 0.0 109.162 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.9 p -68.08 -41.54 81.77 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.215 -0.928 . . . . 0.0 108.744 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.559 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 41.8 m -68.81 -31.69 70.87 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 89.2 tt0 -59.91 -49.44 77.67 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.039 -1.097 . . . . 0.01 108.039 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.03 -39.24 89.04 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.987 -1.116 . . . . 0.01 107.987 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 18.7 t80 -60.02 -40.03 87.88 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.853 -0.795 . . . . 0.01 108.853 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -70.12 -21.61 63.09 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.289 -0.882 . . . . 0.01 110.454 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -85.19 -33.69 22.22 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.703 -1.248 . . . . 0.01 109.638 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.664 HD12 ' NZ ' ' A' ' 64' ' ' LYS . 98.9 mt -72.55 112.49 8.46 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.011 -1.056 . . . . 0.01 108.804 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -97.48 0.03 46.9 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.182 -0.949 . . . . 0.01 109.537 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -91.7 112.59 55.28 Favored Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 108.653 -0.869 . . . . 0.01 108.653 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -68.72 -6.61 18.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 CA-C-N 120.293 1.141 . . . . 0.01 112.465 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 96.4 p -83.99 -22.39 31.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.057 -1.027 . . . . 0.01 109.663 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -94.94 -19.15 20.49 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.072 -1.018 . . . . 0.01 109.597 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 86.7 mt -61.95 -39.98 93.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.108 -0.995 . . . . 0.01 109.167 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -46.79 -65.17 0.75 Allowed Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.01 110.726 -179.389 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 20.7 Cg_exo -38.46 -65.81 0.15 Allowed 'Trans proline' 0 N--CA 1.49 1.278 0 C-N-CA 121.051 1.167 . . . . 0.01 113.878 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.664 ' NZ ' HD12 ' A' ' 55' ' ' ILE . 18.2 pttt -76.89 -21.8 54.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.949 -1.094 . . . . 0.01 111.159 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.03 -49.86 75.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.633 -1.292 . . . . 0.01 108.784 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -60.09 -43.11 95.76 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.46 -0.775 . . . . 0.01 109.41 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -62.78 -50.08 72.46 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 119.377 -0.929 . . . . 0.01 109.961 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.77 -50.06 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.162 -0.962 . . . . 0.01 109.281 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.475 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.8 t80 -61.66 -50.04 74.11 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.541 -0.725 . . . . 0.01 109.928 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.61 -38.04 88.65 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.227 -0.92 . . . . 0.01 109.449 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.2 tt0 -77.43 -61.79 1.87 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 111.923 -178.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -88.79 -26.5 21.68 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.755 -1.215 . . . . 0.0 113.93 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.475 HG21 ' CE1' ' A' ' 69' ' ' TYR . 7.4 mm -99.35 -15.27 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 O-C-N 120.389 -1.445 . . . . 0.01 111.827 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.443 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 31.4 t -58.86 129.33 41.62 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.306 -1.496 . . . . 0.01 108.957 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.93 -16.51 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.078 -1.014 . . . . 0.01 108.298 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -99.56 2.48 44.74 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.485 -0.931 . . . . 0.01 108.485 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.8 139.55 7.41 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.462 -0.774 . . . . 0.01 110.029 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.9 p -70.38 -20.45 62.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.406 -0.808 . . . . 0.01 108.924 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -129.75 79.08 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 66.7 mm-40 -61.73 148.49 42.7 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.405 -0.809 . . . . 0.01 109.662 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 m -109.13 142.74 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.764 HD21 HD21 ' A' ' 42' ' ' ASN . 7.1 p30 -72.36 104.89 3.88 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.197 -0.939 . . . . 0.0 109.706 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.62 160.91 40.97 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.701 -0.851 . . . . 0.01 108.701 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.417 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 2.6 p-10 -73.29 165.12 25.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.01 109.319 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 64.5 m -69.89 -21.3 63.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.01 110.164 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.32 -41.39 22.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.01 109.393 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.527 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 58.7 m -60.48 -50.17 74.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.01 109.949 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -61.62 -49.99 74.36 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.005 -1.059 . . . . 0.01 109.115 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.11 -39.98 88.08 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.302 -0.874 . . . . 0.01 109.466 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.1 -40.69 90.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.01 108.759 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -61.94 -40.37 95.29 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 58.2 p -60.01 -39.67 86.61 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.729 0.776 . . . . 0.01 109.309 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -65.39 -39.9 92.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.25 -0.907 . . . . 0.01 110.119 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -63.18 -21.22 66.07 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.357 -0.839 . . . . 0.01 110.949 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.1 mmm -60.01 -37.14 78.87 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.85 -1.156 . . . . 0.01 109.38 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 62.4 mt -65.74 -29.49 70.02 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.056 -1.09 . . . . 0.01 108.056 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -139.72 79.68 23.22 Favored Pre-proline 0 N--CA 1.495 1.782 0 N-CA-C 108.376 -0.972 . . . . 0.01 108.376 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -59.9 119.54 6.8 Favored 'Trans proline' 0 N--CA 1.49 1.305 0 C-N-CA 120.973 1.116 . . . . 0.01 112.199 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 29.9 p -131.25 170.8 14.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.616 -0.678 . . . . 0.01 109.55 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 100' ' ' ILE . 10.3 tp -72.08 -14.91 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.542 -0.724 . . . . 0.01 109.526 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -93.19 4.09 54.58 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.13 -0.981 . . . . 0.01 109.16 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 25.9 t -61.12 -59.61 5.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.555 -0.716 . . . . 0.01 111.162 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -95.16 -3.19 48.33 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.993 -1.067 . . . . 0.01 111.157 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.15 -39.99 92.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.596 -1.315 . . . . 0.01 108.701 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -64.5 -39.9 94.66 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.211 -0.931 . . . . 0.01 108.728 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -71.42 -47.1 58.1 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.337 -0.852 . . . . 0.0 109.945 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -59.88 -39.97 87.1 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.919 -1.113 . . . . 0.0 108.859 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -59.98 -39.97 87.49 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.169 -1.048 . . . . 0.01 108.169 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.527 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 28.3 mmtp -64.6 -36.74 85.22 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.375 -0.828 . . . . 0.01 108.905 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -65.33 -43.8 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 108.65 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.23 -49.97 75.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.916 -1.115 . . . . 0.0 108.119 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -64.92 -39.89 94.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.051 -1.03 . . . . 0.01 110.192 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 62.2 tp -65.65 -57.21 8.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.187 -0.946 . . . . 0.0 110.421 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 118' ' ' SER . 8.7 ptm -63.18 -39.53 94.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.242 -0.911 . . . . 0.0 110.169 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -67.25 -40.13 86.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.806 -1.183 . . . . 0.01 110.291 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -70.37 -21.49 62.87 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.591 -1.318 . . . . 0.01 110.373 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -119.04 -50.49 2.37 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.252 -0.905 . . . . 0.0 111.693 -178.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 114' ' ' MET . 22.3 p -67.29 -48.07 68.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.7 -1.25 . . . . 0.01 111.534 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.567 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -58.4 -48.87 79.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.896 -1.128 . . . . 0.01 110.54 -178.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -59.46 -42.04 91.11 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.506 -1.294 . . . . 0.01 107.506 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.586 ' O ' ' N ' ' A' ' 125' ' ' SER . 56.3 mtt-85 -69.91 -39.59 76.11 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.531 -0.731 . . . . 0.01 109.977 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.516 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -59.64 -47.35 85.94 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.139 -0.976 . . . . 0.01 110.03 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.08 -39.62 86.72 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.952 -1.092 . . . . 0.01 108.712 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -99.7 10.39 41.42 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.54 -0.725 . . . . 0.01 110.441 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 121' ' ' ARG . 6.7 m -71.45 150.75 44.61 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.91 -1.119 . . . . 0.01 110.087 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.442 HH11 ' HG3' ' A' ' 126' ' ' ARG . 20.4 mtm-85 -65.07 -41.54 95.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.326 -0.859 . . . . 0.01 109.186 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -63.64 -46.43 85.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.283 -0.886 . . . . 0.01 108.753 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 132' ' ' THR . 66.3 t80 -59.89 -47.71 84.65 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.58 -0.7 . . . . 0.01 109.345 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.1 mt -59.96 -49.55 77.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.191 -0.943 . . . . 0.01 109.043 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.09 -48.47 81.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.89 . . . . 3.77 109.391 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.44 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 86.3 mt -69.98 -39.24 76.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 3.8700000000000001 108.87 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.572 ' N ' ' O ' ' A' ' 128' ' ' TYR . 10.8 p -113.17 80.66 1.38 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.584 0.706 . . . . 4.6299999999999999 109.743 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 21.1 m120 . . . . . 0 C--N 1.294 -1.816 0 O-C-N 120.819 -1.176 . . . . 6.4800000000000004 107.954 179.509 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.431 HG22 ' SG ' ' A' ' 25' ' ' CYS . 52.9 t . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.223 -0.658 . . . . 18.699999999999999 109.223 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.1 p -73.46 157.14 37.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.164 -0.96 . . . . 15.970000000000001 109.243 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 133' ' ' ASN . 98.0 mt-30 -69.99 -21.33 63.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 13.82 108.99 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -67.8 -37.27 81.77 Favored 'General case' 0 C--N 1.294 -1.809 0 O-C-N 120.312 -1.493 . . . . 15.06 109.036 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.568 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -72.06 -41.57 67.26 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.493 -0.754 . . . . 14.68 111.422 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.854 HG21 HG22 ' A' ' 132' ' ' THR . 3.5 m -62.57 -36.17 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.539 -1.351 . . . . 11.69 109.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.36 -39.86 84.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.236 -0.915 . . . . 10.51 109.096 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -62.91 -39.8 95.66 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.107 -0.995 . . . . 10.82 108.442 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.48 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 33.8 m0 -60.09 -29.28 68.48 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.921 -1.14 . . . . 6.2599999999999998 107.921 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.75 -8.3 59.63 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.982 -1.074 . . . . 0.01 108.64 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -92.12 -31.58 15.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.201 -0.937 . . . . 0.01 110.422 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -172.39 150.19 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 120.795 -1.191 . . . . 0.01 111.441 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.502 HD23 ' CD2' ' A' ' 111' ' ' PHE . 47.8 tp -60.52 -39.79 89.08 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.776 -0.577 . . . . 0.01 109.709 178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -54.54 -40.24 68.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.852 . . . . 0.01 109.479 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.39 -49.75 76.33 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.962 -1.086 . . . . 0.01 110.241 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 tp -61.11 -40.2 92.87 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.186 -0.947 . . . . 0.01 109.313 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.457 ' O ' HD21 ' A' ' 27' ' ' LEU . 87.8 mt -79.14 -29.93 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.148 -0.97 . . . . 0.01 110.258 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -89.93 0.76 56.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.037 -1.039 . . . . 0.01 110.712 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.568 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.4 t-80 -92.62 138.05 31.84 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.9 -1.125 . . . . 0.01 108.675 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -59.88 -41.34 91.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.221 -0.924 . . . . 0.01 110.657 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.431 ' SG ' HG22 ' A' ' 5' ' ' VAL . 6.0 t -84.96 -29.27 25.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.982 -1.074 . . . . 0.01 108.938 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.05 -45.31 96.17 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 106.749 -2.54 . . . . 0.01 106.749 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 21' ' ' ILE . 72.0 mt -60.09 -46.59 89.1 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.08 72.76 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.262 -0.899 . . . . 0.01 109.64 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.13 -45.88 65.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.407 -0.808 . . . . 0.01 110.068 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' A' ' 34' ' ' LEU . 48.1 t80 -61.05 -46.28 91.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.368 -0.832 . . . . 0.0 109.923 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -59.4 -39.77 84.47 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.123 -0.986 . . . . 0.01 108.429 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.99 -42.6 76.28 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.9 -1.148 . . . . 0.01 107.9 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.451 ' CD2' ' OE1' ' A' ' 37' ' ' GLU . 46.2 t80 -61.83 -38.96 90.12 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.496 -0.752 . . . . 0.01 109.203 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.813 HD11 ' CE2' ' A' ' 30' ' ' PHE . 54.0 mt -60.04 -39.72 86.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.135 -0.978 . . . . 0.0 109.256 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -58.78 -38.06 77.69 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.701 -1.222 . . . . 0.01 107.701 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.8 m -67.01 -24.38 66.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 33' ' ' PHE . 46.6 mt-10 -102.43 0.62 34.12 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.274 -0.891 . . . . 0.01 109.131 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 34' ' ' LEU . 83.4 m-85 56.36 18.78 3.6 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.661 -0.649 . . . . 0.01 109.711 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.557 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 0.9 OUTLIER -99.04 35.72 1.84 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -69.26 -23.11 63.81 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.873 -1.142 . . . . 0.0 110.115 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.578 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 16.6 pm0 -64.75 -28.84 69.86 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.507 -1.371 . . . . 0.0 108.269 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.557 ' ND2' ' OG ' ' A' ' 39' ' ' SER . 98.6 m-20 -61.95 -50.06 73.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.519 -0.738 . . . . 0.0 110.768 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.404 HG23 ' N ' ' A' ' 44' ' ' ASP . 9.9 tp -70.27 -41.79 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.693 -1.254 . . . . 0.0 109.279 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 43' ' ' ILE . 95.5 m-20 -60.93 -43.01 99.22 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 80.4 t80 -61.38 -44.41 97.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.427 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 74.3 t90 -61.78 -41.46 97.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.477 -0.764 . . . . 0.01 109.953 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.5 mt -62.22 -46.84 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.168 -0.957 . . . . 0.0 109.56 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.1 p -67.93 -41.29 82.79 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.093 -1.005 . . . . 0.0 108.613 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.542 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 60.9 m -69.21 -30.32 68.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.713 -0.847 . . . . 0.01 108.713 179.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.427 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 84.0 tt0 -59.68 -47.86 83.96 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 108.158 -1.052 . . . . 0.01 108.158 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -61.09 -40.12 92.54 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -59.88 -40.16 87.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.618 -0.677 . . . . 0.01 110.039 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -76.08 -10.78 59.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.231 -0.918 . . . . 0.01 110.995 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.44 -23.13 17.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.925 -1.11 . . . . 0.01 109.088 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.57 120.37 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.01 108.728 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -95.0 0.29 54.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.106 -0.996 . . . . 0.01 109.771 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.3 m -94.13 110.8 50.31 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.505 -0.924 . . . . 0.01 108.505 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -69.64 -8.86 24.68 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 CA-C-N 120.335 1.155 . . . . 0.01 112.062 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.44 -22.61 28.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.268 -0.895 . . . . 0.01 109.783 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.59 -17.9 26.14 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.182 -0.949 . . . . 0.01 110.092 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.23 -40.15 96.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.376 -0.828 . . . . 0.01 110.695 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.35 -63.31 1.89 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.01 111.14 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.1 Cg_exo -38.25 -61.64 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.153 1.236 . . . . 0.01 113.465 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.488 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -72.06 -25.66 61.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.731 -1.231 . . . . 0.01 110.555 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.92 -48.95 79.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.972 -1.08 . . . . 0.01 109.006 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.424 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 61.1 mttp -61.24 -43.19 99.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.01 109.663 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.0 -50.71 69.67 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.245 -0.909 . . . . 0.01 109.478 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.9 mt -70.02 -41.72 79.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.411 -0.806 . . . . 0.01 109.757 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.522 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.7 t80 -60.18 -48.97 79.47 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.272 -0.892 . . . . 0.01 109.431 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 29.1 m120 -65.31 -40.05 93.26 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.567 -0.708 . . . . 0.01 110.811 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -82.59 -13.14 57.05 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.13 -0.981 . . . . 0.0 112.361 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -134.14 -30.44 1.19 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.697 -1.252 . . . . 0.0 112.873 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.522 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.6 mm -101.24 -42.59 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 120.717 -1.239 . . . . 0.01 111.577 -177.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 76' ' ' GLN . 47.7 t -59.23 133.18 55.86 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.66 -1.275 . . . . 0.01 109.584 -179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -56.13 -7.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.387 -0.82 . . . . 0.01 109.171 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 74' ' ' SER . 94.9 mt-30 -95.76 0.54 52.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.318 -0.864 . . . . 0.01 108.898 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.24 142.57 25.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.405 -0.809 . . . . 0.01 109.241 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.2 p -69.97 -20.06 63.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.027 -1.045 . . . . 0.01 108.567 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -139.49 82.82 1.9 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.738 0.78 . . . . 0.01 109.069 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -63.22 141.84 58.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.079 -1.013 . . . . 0.01 109.896 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.51 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -102.5 153.02 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -71.84 108.3 5.06 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.219 -0.926 . . . . 0.0 109.879 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.4 mt -144.92 160.03 41.97 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.836 -0.802 . . . . 0.01 108.836 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.46 159.36 34.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.283 -0.885 . . . . 0.01 109.429 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.6 m -70.0 -20.4 63.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.246 -0.909 . . . . 0.01 109.639 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -81.79 -44.85 16.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.203 -0.936 . . . . 0.01 109.927 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.6 m -59.93 -43.6 94.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.975 -1.078 . . . . 0.01 109.435 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.7 mtt180 -60.26 -49.98 75.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.082 -1.011 . . . . 0.01 109.53 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.62 -41.06 96.93 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.421 -0.799 . . . . 0.01 109.771 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -60.04 -40.32 88.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.027 -1.045 . . . . 0.01 108.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -62.58 -38.21 89.22 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.09 -1.006 . . . . 0.01 108.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 p -60.03 -40.26 88.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.411 -0.806 . . . . 0.01 109.515 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.1 mtm-85 -70.09 -32.14 70.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.952 -1.093 . . . . 0.01 109.703 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' A' ' 98' ' ' PRO . 98.6 m-20 -65.89 -20.3 66.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.01 110.252 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.4 mmm -60.1 -37.05 78.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.962 -1.087 . . . . 0.01 109.114 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.648 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.6 mp -64.0 -38.93 92.86 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.061 -1.088 . . . . 0.01 108.061 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -140.86 78.51 19.99 Favored Pre-proline 0 N--CA 1.492 1.643 0 N-CA-C 108.482 -0.932 . . . . 0.01 108.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 94' ' ' ASN . 4.3 Cg_exo -64.92 137.16 51.86 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 121.236 1.291 . . . . 0.01 112.553 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.6 p -125.61 171.44 10.56 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 108.769 -0.826 . . . . 0.01 108.769 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.14 -15.8 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 120.96 -1.087 . . . . 0.01 109.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -96.07 8.77 42.88 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.278 -0.889 . . . . 0.01 109.461 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.9 t -60.24 -45.9 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.459 -0.776 . . . . 0.01 109.846 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -96.94 -6.93 34.44 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.206 -0.934 . . . . 0.01 110.936 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -60.02 -40.0 87.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.749 -1.22 . . . . 0.01 108.054 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -64.62 -39.95 94.62 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.911 -0.774 . . . . 0.01 108.911 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.27 -43.81 73.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.311 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -60.26 -39.86 88.27 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.164 -0.96 . . . . 0.0 108.812 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -59.99 -41.17 91.48 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.432 -0.792 . . . . 0.01 108.93 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt -67.6 -40.85 84.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.178 -0.951 . . . . 0.01 109.602 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.7 mm -69.16 -43.8 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.881 -1.137 . . . . 0.0 108.323 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.502 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.2 m-85 -60.02 -50.65 72.88 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.176 -0.952 . . . . 0.0 108.574 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -64.44 -41.21 96.68 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.974 -1.079 . . . . 0.01 109.5 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -65.01 -55.58 18.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.448 -0.783 . . . . 0.0 110.03 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.404 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.8 ptm -64.84 -38.87 92.44 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.132 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 119' ' ' TYR . 86.4 tt0 -60.26 -49.88 75.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.185 -0.947 . . . . 0.01 110.182 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -74.07 -27.66 61.02 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.428 -1.42 . . . . 0.01 110.15 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -91.63 -79.14 0.38 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.196 -0.94 . . . . 0.0 112.699 -177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 122' ' ' PHE . 86.3 p -59.9 -45.2 93.28 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.144 -0.972 . . . . 0.01 112.518 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.48 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -54.34 -48.29 71.56 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 120.613 -1.304 . . . . 0.01 110.552 -178.249 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.21 -39.82 94.02 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.824 -1.172 . . . . 0.01 108.0 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 125' ' ' SER . 14.7 mmm-85 -69.68 -39.41 76.98 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.802 -1.185 . . . . 0.01 107.802 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.5 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.1 t80 -58.71 -49.09 78.89 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 121.537 -0.727 . . . . 0.01 109.347 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.62 -35.59 74.64 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.147 -0.97 . . . . 0.01 108.714 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -97.24 6.83 47.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.01 109.576 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -76.83 161.7 28.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.918 -1.114 . . . . 0.01 110.196 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -69.61 -39.88 76.94 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.607 -0.683 . . . . 0.01 109.789 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -60.54 -49.63 76.79 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.045 -1.035 . . . . 0.01 109.628 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.667 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.4 t80 -59.66 -49.31 78.25 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.12 -0.988 . . . . 0.01 109.251 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.29 -48.41 80.02 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.797 -0.761 . . . . 0.01 109.589 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -62.11 -43.58 98.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 3.77 109.48 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.405 HD22 ' HB ' ' A' ' 5' ' ' VAL . 94.6 mt -72.06 -31.34 66.03 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.276 -0.89 . . . . 3.8700000000000001 109.792 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.854 HG22 HG21 ' A' ' 10' ' ' VAL . 64.1 p -94.36 61.05 2.76 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.081 -1.012 . . . . 4.6299999999999999 110.145 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 2.1 m120 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.392 -0.817 . . . . 6.4800000000000004 108.852 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.498 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 34.0 t . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 108.49 -0.93 . . . . 18.699999999999999 108.49 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.4 p -71.38 160.26 33.08 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.356 -0.84 . . . . 15.970000000000001 109.566 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -69.06 -26.54 65.01 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.37 -0.831 . . . . 13.82 109.535 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -65.08 -40.12 94.17 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.762 -1.211 . . . . 15.06 109.939 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 95.8 mt-10 -74.09 -43.68 56.77 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.308 -0.87 . . . . 14.68 112.208 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 HG22 ' A' ' 132' ' ' THR . 16.4 m -62.02 -30.23 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 120.365 -1.459 . . . . 11.69 110.993 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.04 -40.03 87.98 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.233 -1.542 . . . . 10.51 109.337 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -60.32 -32.77 71.55 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.263 -0.898 . . . . 10.82 108.941 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.529 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 41.6 m0 -59.54 -35.9 75.11 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.18 -0.95 . . . . 6.2599999999999998 108.89 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.93 -7.07 59.41 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.856 -1.153 . . . . 0.01 109.623 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.54 -27.66 17.25 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.946 . . . . 0.01 111.396 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.483 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 68.0 p -172.05 143.84 1.6 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 120.735 -1.228 . . . . 0.01 111.059 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.1 tp -59.99 -40.13 88.12 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.086 0.47 . . . . 0.01 110.724 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.405 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 65.4 mm-40 -53.68 -39.99 65.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.895 -1.128 . . . . 0.01 109.781 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.483 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 94.2 m-20 -62.94 -47.11 84.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.009 -1.057 . . . . 0.01 110.692 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.9 tp -60.0 -46.42 89.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.335 -0.853 . . . . 0.01 109.053 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.407 ' O ' HD21 ' A' ' 27' ' ' LEU . 95.6 mt -72.98 -27.23 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.413 -0.805 . . . . 0.01 110.034 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.3 m120 -90.32 -0.35 57.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.189 -0.945 . . . . 0.01 110.813 -178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.532 ' HD1' ' H ' ' A' ' 26' ' ' GLY . 38.7 t-80 -94.8 136.78 34.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.973 -1.08 . . . . 0.01 109.039 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -60.03 -40.58 89.83 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.299 -0.876 . . . . 0.01 110.403 -178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.498 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.8 t -85.42 -28.4 25.12 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.851 -1.156 . . . . 0.01 108.909 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.532 ' H ' ' HD1' ' A' ' 23' ' ' HIS . . . -59.71 -44.66 96.74 Favored Glycine 0 N--CA 1.48 1.59 0 N-CA-C 106.66 -2.576 . . . . 0.01 106.66 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.407 HD21 ' O ' ' A' ' 21' ' ' ILE . 81.0 mt -59.98 -49.99 75.49 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.241 -1.022 . . . . 0.01 108.241 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.98 -49.84 76.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.063 -1.023 . . . . 0.01 109.307 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.13 -40.08 90.38 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.257 -0.902 . . . . 0.01 109.021 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.613 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 54.6 t80 -64.35 -45.74 86.51 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.366 -0.834 . . . . 0.0 110.656 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -57.85 -39.95 78.95 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.537 -1.352 . . . . 0.01 109.364 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.884 -1.154 . . . . 0.01 107.884 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.52 -40.15 90.44 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.106 -0.996 . . . . 0.01 109.694 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.613 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 98.2 mt -59.83 -39.91 86.7 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -59.93 -38.98 83.94 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.885 -0.783 . . . . 0.01 108.885 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.1 m -59.99 -39.98 87.58 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.264 -0.897 . . . . 0.0 108.895 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -102.32 7.41 40.59 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.473 -0.767 . . . . 0.01 109.048 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.556 ' N ' ' O ' ' A' ' 34' ' ' LEU . 74.6 m-85 52.96 32.6 12.99 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.49 -0.756 . . . . 0.01 109.482 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.3 m -98.89 23.85 8.39 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -63.27 -17.63 62.69 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -64.21 -33.87 76.79 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.506 ' OD1' ' ND2' ' A' ' 82' ' ' ASN . 7.9 m120 -60.51 -49.15 78.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.645 -0.659 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.9 tp -68.68 -40.16 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.717 -1.24 . . . . 0.0 108.91 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -64.17 -42.45 96.72 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.622 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 92.0 t80 -63.03 -40.09 96.69 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.52 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 34.5 t90 -59.89 -40.09 87.56 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.725 -0.609 . . . . 0.01 110.068 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.82 -40.26 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.136 -0.978 . . . . 0.0 109.319 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 93.7 p -68.12 -40.01 82.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.059 -1.026 . . . . 0.0 108.875 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.622 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.0 m -65.81 -37.85 87.37 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.787 . . . . 0.01 109.498 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' OE1' ' CE3' ' A' ' 46' ' ' TRP . 35.9 mt-10 -59.96 -45.96 90.99 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.22 -0.925 . . . . 0.01 108.594 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -59.96 -40.07 87.77 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.208 -1.404 . . . . 0.01 107.208 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.402 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 21.3 t80 -64.39 -41.49 96.64 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.686 -0.634 . . . . 0.01 109.356 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.451 ' NZ ' ' CD ' ' A' ' 107' ' ' GLN . 89.9 mttt -70.89 -21.12 62.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.315 -0.865 . . . . 0.01 110.927 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -88.0 -30.23 20.14 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.813 -1.179 . . . . 0.01 109.265 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 89.4 mt -73.27 115.92 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.283 -0.886 . . . . 0.01 108.768 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -99.25 0.19 42.64 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.302 -0.874 . . . . 0.01 109.984 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.7 m -91.55 112.35 53.86 Favored Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 108.446 -0.946 . . . . 0.01 108.446 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.75 -3.98 13.77 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 120.158 1.092 . . . . 0.01 112.05 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 62.8 p -85.27 -23.78 28.03 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.292 -0.88 . . . . 0.01 109.418 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' O ' ' NZ ' ' A' ' 64' ' ' LYS . 98.6 mttt -93.02 -19.26 21.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.01 109.909 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 80.9 mt -65.45 -40.02 92.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.141 -0.974 . . . . 0.01 109.613 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.427 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -49.63 -62.86 2.07 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.253 -0.904 . . . . 0.01 110.634 -179.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.1 Cg_exo -43.37 -63.61 0.31 Allowed 'Trans proline' 0 N--CA 1.488 1.197 0 C-N-CA 120.62 0.88 . . . . 0.01 112.812 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' O ' ' A' ' 60' ' ' LYS . 9.7 ptpp? -73.72 -25.16 60.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.171 -0.956 . . . . 0.01 111.263 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -58.65 -46.74 86.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.441 -1.412 . . . . 0.01 107.89 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -60.0 -49.09 79.04 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.316 -0.624 . . . . 0.01 109.316 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -62.99 -47.39 83.34 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.172 -0.955 . . . . 0.01 109.107 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.4 -50.0 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.17 -1.048 . . . . 0.01 108.17 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' HG21 ' A' ' 73' ' ' ILE . 59.8 t80 -62.66 -46.4 88.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.595 -0.691 . . . . 0.01 109.616 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -62.25 -40.05 94.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.463 -0.773 . . . . 0.01 110.399 -178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 97.9 mt-10 -85.19 -52.31 6.01 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.071 -1.018 . . . . 0.0 112.687 -178.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -86.5 -34.06 20.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.707 -1.246 . . . . 0.0 113.79 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.418 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -98.0 -22.71 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 120.431 -1.418 . . . . 0.01 112.529 -176.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 91.7 p -57.85 135.86 56.91 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.335 -1.478 . . . . 0.01 109.653 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.22 -15.46 10.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 N-CA-C 108.141 -1.059 . . . . 0.01 108.141 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -94.38 3.0 55.75 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.392 -0.966 . . . . 0.01 108.392 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.45 140.01 6.17 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.748 -0.595 . . . . 0.01 110.016 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.2 p -70.02 -19.34 63.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.01 108.408 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -143.0 81.3 1.72 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.686 -0.857 . . . . 0.01 108.686 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -59.84 139.15 57.54 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.196 -0.94 . . . . 0.01 109.14 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.9 m -90.03 158.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.324 -0.86 . . . . 0.0 108.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.506 ' ND2' ' OD1' ' A' ' 42' ' ' ASN . 26.5 p30 -76.9 99.24 5.15 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 109.841 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.7 mt -144.85 160.17 41.71 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.01 108.808 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 87' ' ' THR . 7.7 p-10 -70.63 159.81 33.72 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.112 -0.992 . . . . 0.01 108.83 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m -69.95 -17.39 63.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.355 -0.841 . . . . 0.01 109.979 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 33.4 t -84.45 -47.21 10.88 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.143 -0.973 . . . . 0.01 110.215 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.411 ' N ' ' OD2' ' A' ' 84' ' ' ASP . 94.5 m -60.02 -40.66 90.08 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.948 -1.095 . . . . 0.01 110.011 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -60.08 -44.92 94.44 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.709 -1.244 . . . . 0.01 108.165 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -60.65 -39.46 88.4 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.762 -0.829 . . . . 0.01 108.762 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -59.01 -40.15 84.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.61 -0.681 . . . . 0.01 109.302 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.8 m -62.66 -40.43 97.04 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.87 -1.144 . . . . 0.01 108.384 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 p -59.95 -38.53 82.71 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.729 0.776 . . . . 0.01 109.33 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.552 ' HG2' HH11 ' A' ' 93' ' ' ARG . 14.2 mtt-85 -68.39 -39.54 81.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.397 -0.814 . . . . 0.01 109.87 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -63.49 -19.13 64.49 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.429 -0.794 . . . . 0.01 110.171 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 40.2 mmm -59.87 -33.22 71.54 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.092 -1.005 . . . . 0.01 109.044 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.52 -25.0 67.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.142 -1.059 . . . . 0.01 108.142 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -144.51 80.7 11.66 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.439 -0.949 . . . . 0.01 108.439 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -58.12 117.02 3.66 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 120.908 1.072 . . . . 0.01 112.332 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 35.3 p -128.61 170.37 13.32 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 109.138 -0.69 . . . . 0.01 109.138 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.94 -17.04 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.423 -0.798 . . . . 0.01 109.299 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.9 p -91.37 7.13 42.51 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.216 -0.927 . . . . 0.01 109.676 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 33.5 t -59.24 -64.21 1.02 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.308 -0.87 . . . . 0.01 110.672 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.21 -1.88 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.148 -0.97 . . . . 0.01 111.125 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -61.14 -39.93 91.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.589 -1.319 . . . . 0.01 108.507 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.511 ' HA ' ' HZ3' ' A' ' 108' ' ' LYS . 53.0 tp10 -64.22 -40.02 95.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.504 -0.747 . . . . 0.01 109.061 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -50.47 48.51 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.204 -0.935 . . . . 0.0 108.964 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.452 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 57.8 tt0 -60.1 -40.13 88.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.313 -0.867 . . . . 0.0 109.851 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.511 ' HZ3' ' HA ' ' A' ' 105' ' ' GLU . 7.9 ttpm? -59.93 -39.8 86.71 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.142 -0.974 . . . . 0.01 108.806 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -62.09 -37.04 83.54 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.242 -0.911 . . . . 0.01 108.734 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.17 -47.63 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.623 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.95 -52.35 65.78 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -64.78 -40.55 95.44 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.319 -0.863 . . . . 0.01 109.776 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.457 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 39.3 tp -64.59 -57.74 8.27 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.081 -1.012 . . . . 0.0 110.693 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.428 ' SD ' HD21 ' A' ' 17' ' ' LEU . 10.7 ptm -63.15 -40.05 96.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.002 . . . . 0.0 110.017 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -61.84 -40.03 93.88 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.163 -0.961 . . . . 0.01 110.994 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -70.81 -39.96 72.77 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.249 -1.532 . . . . 0.01 111.652 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 118' ' ' SER . 39.2 p-10 -108.27 -47.98 3.43 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.015 -1.053 . . . . 0.0 112.3 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.545 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.2 p -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.467 -1.396 . . . . 0.01 110.562 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.529 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.27 -51.17 71.1 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.01 110.467 -178.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -60.18 -40.14 88.93 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 120.717 -1.239 . . . . 0.01 107.763 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.569 ' O ' ' N ' ' A' ' 125' ' ' SER . 51.7 mtt-85 -70.0 -36.37 75.07 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.532 -0.73 . . . . 0.01 109.055 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -58.48 -49.04 78.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.126 -0.984 . . . . 0.01 108.912 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.72 -38.17 80.92 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 108.196 -1.039 . . . . 0.01 108.196 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -90.1 -0.01 57.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.424 -0.797 . . . . 0.01 109.553 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 121' ' ' ARG . 43.2 t -77.71 148.25 35.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.19 -0.944 . . . . 0.01 109.456 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -61.47 -38.05 85.85 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.429 -0.794 . . . . 0.01 110.487 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -57.72 -49.2 77.34 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.79 -1.194 . . . . 0.01 108.963 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.744 ' CE1' HG21 ' A' ' 132' ' ' THR . 67.4 t80 -60.02 -49.46 77.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.256 -0.903 . . . . 0.01 108.804 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.0 -44.89 94.26 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.197 -0.939 . . . . 0.01 108.914 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.54 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 89.8 m-20 -60.06 -49.11 78.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.076 -1.015 . . . . 3.77 108.757 179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.88 -40.01 75.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 3.8700000000000001 108.966 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.744 HG21 ' CE1' ' A' ' 128' ' ' TYR . 20.6 p -101.39 70.64 1.31 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.537 0.684 . . . . 4.6299999999999999 109.211 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 83.7 m-20 . . . . . 0 C--N 1.297 -1.678 0 N-CA-C 108.723 -0.843 . . . . 6.4800000000000004 108.723 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.561 HG22 ' SG ' ' A' ' 25' ' ' CYS . 14.2 t . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 109.281 -0.637 . . . . 18.699999999999999 109.281 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.4 p -73.73 157.21 36.92 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.223 -0.923 . . . . 15.970000000000001 109.565 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.21 -21.84 62.98 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.076 -1.015 . . . . 13.82 109.594 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.82 -38.97 76.75 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.127 -0.983 . . . . 15.06 109.945 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -71.45 -45.7 61.92 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.136 -0.977 . . . . 14.68 111.277 -178.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.8 HG21 HG22 ' A' ' 132' ' ' THR . 35.9 m -62.72 -36.2 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.814 -1.179 . . . . 11.69 109.556 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -39.1 83.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.963 -1.086 . . . . 10.51 108.678 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -60.0 -34.85 73.89 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.473 -0.936 . . . . 10.82 108.473 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.55 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.2 m0 -59.41 -30.02 68.16 Favored 'General case' 0 C--O 1.202 -1.427 0 N-CA-C 107.91 -1.144 . . . . 6.2599999999999998 107.91 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.74 -8.72 59.73 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 120.642 -1.286 . . . . 0.01 108.641 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -95.33 -24.52 16.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.337 -0.852 . . . . 0.01 111.656 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.49 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.0 p -171.86 139.43 1.16 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.499 -1.376 . . . . 0.01 111.335 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' CD2' ' A' ' 111' ' ' PHE . 41.1 tp -59.88 -43.21 94.86 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.826 -0.546 . . . . 0.01 110.507 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 18' ' ' GLU . 56.2 mp0 -54.69 -39.97 68.67 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.061 -1.024 . . . . 0.01 109.944 -179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.52 -44.01 97.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.081 -1.012 . . . . 0.01 109.781 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.12 -48.52 81.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.944 -1.097 . . . . 0.01 108.344 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.676 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.9 mt -73.1 -33.31 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 CA-C-N 116.162 -0.472 . . . . 0.01 111.21 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.3 m120 -89.51 -0.02 57.21 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.803 -1.186 . . . . 0.01 111.589 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 -93.01 136.54 33.18 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.666 -1.272 . . . . 0.01 108.795 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.9 -40.07 83.37 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.201 -0.937 . . . . 0.01 110.153 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.561 ' SG ' HG22 ' A' ' 5' ' ' VAL . 6.6 t -81.8 -36.46 28.39 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 120.584 -1.322 . . . . 0.01 108.25 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.469 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -58.59 -41.99 95.87 Favored Glycine 0 C--O 1.208 -1.492 0 N-CA-C 106.919 -2.472 . . . . 0.01 106.919 178.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD21 ' O ' ' A' ' 21' ' ' ILE . 53.1 mt -58.03 -44.27 87.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.71 -0.877 . . . . 0.01 109.689 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.96 -55.18 32.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.833 -1.167 . . . . 0.01 110.149 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.87 81.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.01 109.784 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.52 ' HE1' HD13 ' A' ' 43' ' ' ILE . 41.0 t80 -59.95 -53.35 58.87 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.519 -0.738 . . . . 0.0 110.847 -178.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -61.02 -40.21 92.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.01 110.538 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.82 -51.12 44.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.189 -0.944 . . . . 0.01 111.424 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -59.77 -48.27 82.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.954 -1.091 . . . . 0.01 111.321 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 37.1 mt -60.15 -38.84 84.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.886 -1.134 . . . . 0.0 109.087 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -55.65 -39.24 70.64 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.286 -1.376 . . . . 0.01 107.286 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.4 m -65.8 -18.95 65.69 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.486 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 64.6 mm-40 -106.15 9.32 32.3 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.496 -0.752 . . . . 0.01 109.482 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 57.64 24.76 10.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.636 -0.665 . . . . 0.01 110.115 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.9 m -100.42 18.46 18.93 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.9 pt-20 -68.69 -20.82 64.44 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.374 -0.829 . . . . 0.0 109.138 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.9 pt-20 -62.13 -35.52 78.99 Favored 'General case' 0 C--N 1.296 -1.746 0 O-C-N 120.58 -1.325 . . . . 0.0 107.928 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.543 ' ND2' HD12 ' A' ' 110' ' ' ILE . 14.5 m120 -60.63 -44.22 96.61 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.75 -0.594 . . . . 0.0 110.971 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 30' ' ' PHE . 6.4 tp -69.94 -40.13 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 120.612 -1.305 . . . . 0.0 109.392 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.49 -41.47 97.31 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.604 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 81.7 t80 -65.26 -42.01 93.68 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 107' ' ' GLN . 62.4 t90 -61.76 -44.8 96.19 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.649 -0.657 . . . . 0.01 109.953 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.1 mt -60.12 -45.5 95.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.103 -0.998 . . . . 0.0 109.049 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 89.0 p -66.02 -40.07 90.74 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.258 -0.901 . . . . 0.0 108.722 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.604 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 81.1 m -69.45 -33.35 72.81 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.331 -0.856 . . . . 0.01 109.77 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -59.8 -44.75 93.8 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.69 -1.256 . . . . 0.01 108.318 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -60.2 -39.89 88.13 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.651 -1.241 . . . . 0.01 107.651 178.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.19 -42.94 99.41 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.593 0.711 . . . . 0.01 109.364 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.405 ' HZ1' ' HB2' ' A' ' 107' ' ' GLN . 37.5 mttp -70.14 -20.83 63.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.587 -0.696 . . . . 0.01 110.57 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -93.12 -24.31 18.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.928 -1.108 . . . . 0.01 109.584 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 65.8 mt -72.56 117.84 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 N-CA-C 108.049 -1.093 . . . . 0.01 108.049 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -98.22 0.04 45.03 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.273 -0.892 . . . . 0.01 109.513 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -93.82 112.27 56.26 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.373 -0.829 . . . . 0.01 108.794 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -68.6 -3.85 11.95 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 CA-C-N 120.254 1.126 . . . . 0.01 111.875 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 80.7 p -85.04 -27.99 25.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.01 109.693 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -91.45 -18.03 24.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.01 110.087 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.7 mt -60.78 -40.13 91.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.016 -1.052 . . . . 0.01 109.755 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -52.03 -64.5 1.46 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.01 111.173 -179.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.2 Cg_exo -43.3 -55.86 2.64 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.197 1.265 . . . . 0.01 113.79 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -32.12 69.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.883 -1.136 . . . . 0.01 110.192 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.08 89.09 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.714 -1.241 . . . . 0.01 108.943 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -60.93 -45.27 95.36 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.408 -0.808 . . . . 0.01 109.861 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.52 -46.68 87.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.134 -0.979 . . . . 0.01 109.238 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.2 mt -69.19 -47.62 73.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 O-C-N 121.411 -0.806 . . . . 0.01 109.137 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.0 t80 -60.64 -47.42 86.31 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.923 0.868 . . . . 0.01 109.412 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.46 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.86 -40.02 91.37 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 121.544 0.688 . . . . 0.01 109.988 -179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -80.11 -65.23 1.03 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.005 -1.059 . . . . 0.0 112.036 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.542 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 96.5 m-85 -79.37 -33.31 42.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.597 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.3 mm -96.9 -10.51 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.377 -1.452 . . . . 0.01 112.366 -176.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 5.0 m -59.52 129.82 43.83 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.344 -1.473 . . . . 0.01 108.964 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.7 m -59.78 -18.08 14.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 108.634 -0.876 . . . . 0.01 108.634 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -98.54 1.64 46.74 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 108.745 -0.835 . . . . 0.01 108.745 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.71 138.25 8.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.381 -0.824 . . . . 0.01 109.388 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 44.0 p -70.09 -19.78 63.24 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.281 -0.887 . . . . 0.01 109.544 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.542 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 16.2 pttp -135.61 87.0 2.28 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.456 ' OE2' ' O ' ' A' ' 74' ' ' SER . 49.3 mm-40 -65.86 147.73 52.91 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.37 -0.831 . . . . 0.01 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -103.81 142.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.437 ' CG ' ' CD2' ' A' ' 113' ' ' LEU . 5.1 p30 -73.17 109.03 6.38 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.979 -1.075 . . . . 0.0 109.801 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 84.5 mt -143.2 161.48 38.13 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 93.9 m-20 -70.08 159.94 32.93 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.181 -0.949 . . . . 0.01 109.681 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.409 ' HA ' HH22 ' A' ' 88' ' ' ARG . 71.0 m -61.53 -37.72 84.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.475 -0.766 . . . . 0.01 109.752 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.2 -34.13 43.24 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.221 -0.924 . . . . 0.01 109.9 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.2 m -60.12 -49.44 77.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.11 -0.994 . . . . 0.01 110.093 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.437 ' HG3' HH11 ' A' ' 88' ' ' ARG . 38.4 mtm-85 -62.69 -49.63 74.36 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.714 -1.241 . . . . 0.01 108.963 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -60.12 -39.54 86.61 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.983 -0.747 . . . . 0.01 108.983 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 86.6 tt0 -59.78 -39.97 86.69 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.442 -0.786 . . . . 0.01 109.259 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 91.9 m -61.66 -42.76 99.36 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.829 -1.17 . . . . 0.01 108.23 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.6 p -60.88 -40.08 91.65 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.249 -0.907 . . . . 0.01 108.985 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -64.3 -39.92 94.89 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.58 -0.7 . . . . 0.01 109.564 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -64.49 -14.68 58.42 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.427 -0.796 . . . . 0.01 109.897 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 5.1 mmt -60.12 -37.16 79.18 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.1 -1.0 . . . . 0.01 109.077 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 96' ' ' LEU . 8.3 mp -64.21 -36.32 83.68 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.239 -1.022 . . . . 0.01 108.239 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -141.3 79.24 17.84 Favored Pre-proline 0 N--CA 1.494 1.771 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.57 123.59 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 C-N-CA 120.977 1.118 . . . . 0.01 112.207 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 82.7 p -112.72 166.36 11.43 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.681 -0.859 . . . . 0.01 108.681 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.52 -21.88 20.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.235 -0.915 . . . . 0.01 109.513 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.3 p -93.23 8.92 38.29 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.19 -0.944 . . . . 0.01 109.632 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -61.18 -44.97 96.45 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.302 -0.874 . . . . 0.01 109.949 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -96.48 -12.23 24.45 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.025 -1.047 . . . . 0.01 110.418 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -60.17 -40.04 88.54 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.832 -1.168 . . . . 0.01 108.615 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 85.9 tt0 -64.58 -38.63 91.67 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.552 -0.907 . . . . 0.01 108.552 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.33 -44.74 78.37 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.4 -0.812 . . . . 0.0 109.25 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 46' ' ' TRP . 29.9 tt0 -60.02 -40.06 88.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.07 -1.019 . . . . 0.0 108.914 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -59.75 -41.7 91.56 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.232 -1.025 . . . . 0.01 108.232 179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 70.6 mmtt -67.12 -40.02 86.77 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.404 -0.81 . . . . 0.01 108.862 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.543 HD12 ' ND2' ' A' ' 42' ' ' ASN . 38.9 mm -67.9 -45.11 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.936 -1.103 . . . . 0.0 108.205 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.627 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -60.04 -47.41 85.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.493 -0.754 . . . . 0.0 109.598 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.91 -42.03 98.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.885 -1.134 . . . . 0.01 109.837 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' CD2' ' CG ' ' A' ' 82' ' ' ASN . 64.5 tp -61.83 -58.69 7.01 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 110.456 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.519 ' O ' ' N ' ' A' ' 118' ' ' SER . 16.9 ptm -65.71 -42.11 91.49 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.352 -0.842 . . . . 0.0 109.881 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 114' ' ' MET . 86.4 tt0 -60.01 -40.22 88.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.309 -0.869 . . . . 0.01 110.184 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -72.02 -38.71 69.53 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.379 -1.451 . . . . 0.01 110.574 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -107.77 -49.45 3.22 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.185 -0.947 . . . . 0.0 112.497 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 114' ' ' MET . 17.7 p -60.0 -45.33 93.1 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.464 -1.398 . . . . 0.01 110.689 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.55 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.29 -45.63 87.58 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.104 -0.997 . . . . 0.01 109.013 -179.686 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.577 ' HG2' HH11 ' A' ' 120' ' ' ARG . 11.8 mtt-85 -60.36 -38.65 84.52 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.069 -1.086 . . . . 0.01 108.069 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.1 -40.03 75.16 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.488 -0.757 . . . . 0.01 109.406 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -60.06 -48.47 81.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.048 -1.032 . . . . 0.01 109.664 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.06 -39.94 87.74 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.111 -0.993 . . . . 0.01 108.447 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -87.59 -3.44 58.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.491 -0.756 . . . . 0.01 110.11 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.508 ' N ' ' O ' ' A' ' 121' ' ' ARG . 48.9 m -65.87 143.34 57.5 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.962 -1.086 . . . . 0.01 109.865 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -60.19 -39.9 88.14 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.591 -0.693 . . . . 0.01 109.217 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -59.52 -49.28 78.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.01 108.893 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.771 ' CZ ' HG21 ' A' ' 132' ' ' THR . 78.1 t80 -59.98 -49.12 78.94 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.192 -0.943 . . . . 0.01 108.66 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.42 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 83.7 mt -60.34 -43.46 96.42 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.558 -0.714 . . . . 0.01 109.085 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.523 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 66.1 m-20 -60.06 -48.95 79.57 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.364 -0.835 . . . . 3.77 108.85 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.05 -39.05 75.92 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.243 -1.021 . . . . 3.8700000000000001 108.243 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.8 HG22 HG21 ' A' ' 10' ' ' VAL . 22.2 p -101.25 67.61 1.18 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.798 -0.564 . . . . 4.6299999999999999 110.189 -179.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 41.3 m-20 . . . . . 0 N--CA 1.493 1.725 0 O-C-N 120.998 -1.064 . . . . 6.4800000000000004 108.991 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.506 HG22 ' SG ' ' A' ' 25' ' ' CYS . 46.8 t . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 109.149 -0.685 . . . . 18.699999999999999 109.149 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.1 p -74.44 159.26 32.54 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.169 -0.957 . . . . 15.970000000000001 109.353 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -70.75 -20.72 62.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 13.82 109.016 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.76 -37.36 86.15 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.842 -1.161 . . . . 15.06 108.755 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.514 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 78.7 mm-40 -76.95 -43.72 34.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.3 -0.875 . . . . 14.68 112.291 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 132' ' ' THR . 4.4 m -60.02 -43.18 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.652 -1.28 . . . . 11.69 110.514 -178.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -60.08 -39.94 87.85 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 120.9 -1.125 . . . . 10.51 108.068 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.36 -31.15 72.24 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.535 -0.728 . . . . 10.82 109.07 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.548 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 40.0 m0 -59.72 -33.63 71.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.957 -1.089 . . . . 6.2599999999999998 108.495 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.62 -9.15 59.58 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.944 -1.098 . . . . 0.01 109.348 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -87.97 -36.45 17.06 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.209 -0.932 . . . . 0.01 111.108 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.471 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 46.9 p -171.29 148.42 2.63 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.714 -1.241 . . . . 0.01 110.899 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 111' ' ' PHE . 30.2 tp -59.43 -39.78 84.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.716 -0.615 . . . . 0.01 110.042 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.48 ' O ' ' ND2' ' A' ' 22' ' ' ASN . 99.5 mt-10 -51.04 -43.33 60.91 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.452 -0.78 . . . . 0.01 110.676 -178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -64.03 -42.41 97.11 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.815 -1.178 . . . . 0.01 111.163 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.97 -48.05 83.29 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.203 -0.935 . . . . 0.01 110.117 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.4 pt -76.7 -13.74 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.164 -0.96 . . . . 0.01 110.516 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' ND2' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -85.84 -15.09 43.01 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.915 -1.116 . . . . 0.01 110.273 -178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.491 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -91.37 131.92 36.54 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.863 -1.148 . . . . 0.01 109.293 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.469 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.2 tt0 -60.01 -39.8 87.04 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.403 -0.81 . . . . 0.01 110.059 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' HG22 ' A' ' 5' ' ' VAL . 9.0 t -81.26 -32.23 33.37 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.081 -1.012 . . . . 0.01 108.477 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.31 -42.92 99.0 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 107.465 -2.254 . . . . 0.01 107.465 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.3 mt -60.12 -41.0 91.67 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 107.711 -1.218 . . . . 0.01 107.711 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.59 90.84 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.222 -0.924 . . . . 0.01 108.66 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.98 -41.81 77.37 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.09 -1.078 . . . . 0.01 108.09 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.576 ' CZ ' ' SD ' ' A' ' 114' ' ' MET . 51.8 t80 -60.26 -44.47 95.25 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -59.88 -42.14 93.13 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.979 -1.076 . . . . 0.01 108.978 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.047 -1.033 . . . . 0.01 108.215 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -60.16 -39.91 88.05 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.491 -0.756 . . . . 0.01 109.608 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 30' ' ' PHE . 73.2 mt -59.36 -38.16 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.773 -1.204 . . . . 0.0 108.385 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -59.89 -37.19 78.69 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.176 -0.953 . . . . 0.01 108.513 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -59.97 -36.04 76.27 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -101.19 5.47 42.66 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.292 -0.88 . . . . 0.01 108.626 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.416 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.0 m-85 56.03 31.09 17.37 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.329 0.585 . . . . 0.01 109.967 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 t -107.16 41.83 1.41 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -66.11 -24.41 66.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.03 -1.044 . . . . 0.0 109.179 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.427 ' OE1' ' O ' ' A' ' 79' ' ' LYS . 17.1 pt-20 -62.39 -27.17 68.9 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.83 -1.169 . . . . 0.0 108.812 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 42' ' ' ASN . 1.4 m-80 -59.96 -44.81 94.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.306 -0.871 . . . . 0.0 110.651 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.6 tp -69.94 -40.16 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 120.503 -1.373 . . . . 0.0 108.562 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -62.84 -41.89 99.52 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -66.37 -41.61 89.19 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.3 t90 -60.07 -47.58 85.27 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.834 -0.802 . . . . 0.01 108.834 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.5 mt -60.53 -45.18 97.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.7 p -68.04 -39.95 82.96 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.192 -0.942 . . . . 0.0 108.644 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.456 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 7.2 t -68.39 -39.14 81.8 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -59.95 -41.75 92.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.032 -1.043 . . . . 0.01 108.845 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.38 -39.97 89.18 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.826 -1.175 . . . . 0.01 107.826 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -60.31 -41.6 93.81 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.217 -0.661 . . . . 0.01 109.217 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.556 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 58.5 mttp -70.8 -20.64 62.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.137 -0.977 . . . . 0.01 110.547 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -85.51 -30.71 23.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.088 -1.007 . . . . 0.01 109.422 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.1 mt -73.52 118.33 18.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.133 -0.98 . . . . 0.01 108.723 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -98.64 -0.06 43.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.387 -0.82 . . . . 0.01 109.191 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.6 m -95.59 111.62 56.2 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.466 -0.771 . . . . 0.01 109.067 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -69.47 1.67 4.04 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 120.167 1.095 . . . . 0.01 111.857 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.7 m -85.77 -30.37 23.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.21 -0.932 . . . . 0.01 109.732 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -91.17 -16.96 26.86 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.076 -1.015 . . . . 0.01 110.213 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.78 -40.0 95.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.997 -1.064 . . . . 0.01 110.016 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -52.23 -64.33 1.6 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.141 -0.975 . . . . 0.01 111.174 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.5 Cg_exo -44.76 -56.15 2.84 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 120.745 0.963 . . . . 0.01 112.947 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -71.91 -30.35 65.26 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.021 -1.049 . . . . 0.01 110.078 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.75 84.21 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.058 -1.026 . . . . 0.01 108.761 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -60.8 -44.28 97.06 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.459 -0.776 . . . . 0.01 109.267 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -49.85 70.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.436 -0.79 . . . . 0.01 109.434 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 95.4 mt -68.5 -41.91 83.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 121.321 -0.862 . . . . 0.01 108.86 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.577 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 44.9 t80 -61.19 -50.2 74.11 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 121.706 0.765 . . . . 0.01 110.34 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -61.54 -38.33 87.06 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.199 -0.938 . . . . 0.01 110.06 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.64 -63.99 1.29 Allowed 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.205 -0.935 . . . . 0.0 112.11 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -84.46 -26.01 28.5 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.344 1.239 . . . . 0.0 114.344 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.472 HD12 ' HE ' ' A' ' 88' ' ' ARG . 50.7 mm -98.58 -20.97 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 O-C-N 120.167 -1.583 . . . . 0.01 111.595 -177.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -58.95 127.89 34.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.548 -1.345 . . . . 0.01 109.899 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -62.42 -18.27 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 108.688 -0.856 . . . . 0.01 108.688 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -95.15 0.24 53.98 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.735 -0.839 . . . . 0.01 108.735 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.91 144.99 5.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.611 -0.68 . . . . 0.01 109.752 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -70.11 -19.94 63.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.097 -1.002 . . . . 0.01 108.785 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.427 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 38.1 pttt -136.79 80.81 1.84 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.453 -0.779 . . . . 0.01 109.428 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 43.5 mt-10 -64.78 140.28 58.85 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.166 -0.959 . . . . 0.01 108.942 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 81' ' ' VAL . 4.5 m -89.29 155.74 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.042 -1.036 . . . . 0.0 109.348 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -74.47 100.97 3.99 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.445 -0.785 . . . . 0.0 109.158 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.565 HD13 ' NH1' ' A' ' 88' ' ' ARG . 52.2 mt -146.63 163.97 34.13 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 109.031 -0.729 . . . . 0.01 109.031 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -71.01 150.9 45.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 0.01 110.03 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.2 m -69.83 -21.7 63.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.533 -0.73 . . . . 0.01 109.646 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 31.4 t -81.58 -37.63 27.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.188 -0.945 . . . . 0.01 109.493 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.503 ' CG2' ' NH1' ' A' ' 88' ' ' ARG . 69.3 m -60.64 -38.41 84.71 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.115 -0.991 . . . . 0.01 108.343 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.565 ' NH1' HD13 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -59.96 -49.62 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.914 . . . . 0.01 109.154 179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.03 -39.98 87.74 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.085 -1.45 . . . . 0.01 107.085 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -62.03 -39.98 94.17 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.774 -0.579 . . . . 0.01 109.764 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.7 m -60.54 -44.64 95.87 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.632 -1.292 . . . . 0.01 109.351 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.9 p -58.55 -37.53 75.89 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.411 -0.805 . . . . 0.01 109.001 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -64.5 -39.94 94.73 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.492 -0.929 . . . . 0.01 108.492 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -67.98 -26.76 66.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.532 -0.73 . . . . 0.01 109.937 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.577 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 60.5 mtp -59.99 -39.21 84.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.004 -1.06 . . . . 0.01 108.886 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.93 -20.83 66.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.198 -1.038 . . . . 0.01 108.198 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -144.63 80.25 11.82 Favored Pre-proline 0 N--CA 1.495 1.775 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -60.15 116.18 3.14 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 120.998 1.132 . . . . 0.01 112.888 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.2 p -123.99 169.99 11.09 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.534 -0.913 . . . . 0.01 108.534 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.64 -18.28 20.99 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 121.105 -0.997 . . . . 0.01 109.223 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.9 p -93.61 7.28 45.31 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.191 -0.943 . . . . 0.01 109.813 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.94 -61.66 2.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.271 -0.893 . . . . 0.01 110.87 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -93.27 -2.31 55.16 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.155 -0.966 . . . . 0.01 111.075 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -60.96 -39.9 91.31 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.612 -1.305 . . . . 0.01 109.183 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.86 -37.08 83.2 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.523 -0.735 . . . . 0.01 109.065 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.68 -52.89 32.56 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.357 -0.839 . . . . 0.0 109.483 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.556 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 17.6 tt0 -59.27 -37.27 77.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.057 -1.027 . . . . 0.0 108.562 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -59.94 -40.0 87.46 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.872 -1.159 . . . . 0.01 107.872 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -67.68 -35.14 78.29 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.414 -0.804 . . . . 0.01 108.918 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.2 mm -64.2 -39.99 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.261 -0.899 . . . . 0.0 108.819 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -58.05 -53.72 55.02 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -62.3 -40.01 94.87 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.679 -0.638 . . . . 0.01 109.799 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.513 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.7 OUTLIER -57.47 -62.09 2.03 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -178.496 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.576 ' SD ' ' CZ ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -69.19 -33.33 73.18 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 120.766 -1.209 . . . . 0.0 110.647 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.493 ' HG3' HD22 ' A' ' 17' ' ' LEU . 85.1 mt-10 -60.0 -40.09 88.01 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.341 -1.474 . . . . 0.01 109.536 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -69.95 -39.8 75.84 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 120.552 -1.342 . . . . 0.01 111.361 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.51 -37.3 7.63 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.033 -1.042 . . . . 0.0 112.132 -178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 114' ' ' MET . 23.0 p -78.49 -49.48 13.33 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.603 -1.311 . . . . 0.01 112.423 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.548 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -56.4 -50.34 71.9 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.703 -1.248 . . . . 0.01 110.371 -178.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -60.15 -43.45 95.73 Favored 'General case' 0 C--N 1.295 -1.773 0 O-C-N 120.96 -1.087 . . . . 0.01 108.624 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 50.1 mtp180 -70.07 -39.03 75.86 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.525 -0.734 . . . . 0.01 109.695 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.497 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -58.36 -44.88 88.99 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.943 -1.098 . . . . 0.01 108.936 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.12 -37.66 80.7 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.841 -1.162 . . . . 0.01 108.887 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -106.81 19.46 20.43 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.403 -0.81 . . . . 0.01 109.902 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 28.2 p -81.76 155.08 25.65 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.834 -1.166 . . . . 0.01 110.443 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -63.97 -40.41 96.33 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.188 -0.671 . . . . 0.01 109.188 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -63.25 -50.09 71.54 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.254 -0.904 . . . . 0.01 109.796 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 54.2 t80 -60.13 -47.36 86.24 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.577 -0.702 . . . . 0.01 109.393 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.17 -46.32 90.11 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.485 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.0 m-20 -59.97 -45.0 94.1 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.211 -0.931 . . . . 3.77 108.824 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -69.88 -38.66 76.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.441 -0.787 . . . . 3.8700000000000001 109.221 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 17.7 p -107.77 74.79 0.97 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.639 -0.663 . . . . 4.6299999999999999 109.347 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 59.6 m-80 . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.061 -1.024 . . . . 6.4800000000000004 108.45 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 109.366 -0.605 . . . . 18.699999999999999 109.366 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.5 p -75.74 163.23 27.49 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.235 -0.916 . . . . 15.970000000000001 109.674 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.456 HE22 ' H ' ' A' ' 133' ' ' ASN . 94.6 mm-40 -68.1 -26.8 66.0 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.24 -0.913 . . . . 13.82 109.517 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -69.26 -40.07 78.05 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 120.988 -1.07 . . . . 15.06 110.675 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.681 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 98.9 mt-10 -72.51 -40.32 66.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.158 -0.964 . . . . 14.68 111.742 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.749 HG21 HG22 ' A' ' 132' ' ' THR . 22.8 m -63.34 -31.39 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 120.392 -1.443 . . . . 11.69 109.218 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -60.03 -33.71 72.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.196 -0.94 . . . . 10.51 108.914 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -60.01 -37.62 80.27 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.402 -1.333 . . . . 10.82 107.402 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.47 ' N ' ' CD1' ' A' ' 13' ' ' TRP . 27.7 m0 -59.8 -26.22 65.59 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.631 -0.877 . . . . 6.2599999999999998 108.631 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.2 -9.99 59.69 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.502 -1.374 . . . . 0.01 109.102 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -94.33 -26.65 16.48 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.255 -0.903 . . . . 0.01 110.824 -179.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 87.3 p -170.8 145.94 2.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.583 -1.323 . . . . 0.01 111.528 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 111' ' ' PHE . 34.0 tp -60.83 -40.24 92.08 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.302 0.572 . . . . 0.01 109.645 178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -55.11 -39.76 69.71 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.253 -0.904 . . . . 0.01 109.31 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.05 -48.05 83.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.01 109.55 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.99 -49.01 79.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.097 -1.002 . . . . 0.01 108.83 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.419 ' O ' HD21 ' A' ' 27' ' ' LEU . 98.3 mt -70.07 -27.05 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.282 -0.886 . . . . 0.01 110.008 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.45 ' N ' ' O ' ' A' ' 18' ' ' GLU . 98.6 m-20 -89.29 -0.71 57.67 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.017 -1.052 . . . . 0.01 110.598 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.681 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 51.4 t-80 -94.34 138.63 32.09 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.783 -1.198 . . . . 0.01 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.07 -39.96 87.88 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.406 -0.809 . . . . 0.01 110.108 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.1 t -82.74 -27.42 31.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.995 -1.066 . . . . 0.01 108.399 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -64.15 -49.8 64.31 Favored Glycine 0 C--O 1.205 -1.718 0 N-CA-C 108.105 -1.998 . . . . 0.01 108.105 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.9 mt -59.7 -49.83 76.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.097 -1.237 . . . . 0.01 109.162 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.88 -49.87 76.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.98 -1.075 . . . . 0.01 109.069 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.99 81.74 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.434 -0.791 . . . . 0.01 109.506 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.689 ' CE2' HD11 ' A' ' 34' ' ' LEU . 45.8 t80 -68.63 -46.07 70.2 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.31 -0.869 . . . . 0.0 111.235 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -59.61 -40.67 88.31 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.471 -1.393 . . . . 0.01 109.324 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.23 -40.41 77.94 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.879 -1.138 . . . . 0.01 107.989 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.16 -39.94 88.15 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.605 -0.684 . . . . 0.01 109.874 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.689 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.1 mt -60.02 -40.03 87.88 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.052 -1.03 . . . . 0.0 108.222 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -58.22 -38.93 77.75 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.405 -0.961 . . . . 0.01 108.405 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.0 m -59.92 -35.53 75.1 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.26 -0.9 . . . . 0.0 109.004 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -100.02 4.48 44.81 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.32 -0.862 . . . . 0.01 108.863 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 58.23 27.31 14.98 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.49 0.662 . . . . 0.01 109.583 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 p -100.89 23.78 10.16 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -64.51 -19.76 65.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 109.098 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.9 pt-20 -62.14 -34.48 76.44 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.765 -1.21 . . . . 0.0 108.231 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.722 HD21 HD21 ' A' ' 82' ' ' ASN . 96.1 m-20 -60.42 -47.42 86.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 tp -69.92 -40.08 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 120.39 -1.444 . . . . 0.0 108.758 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.2 -43.76 95.67 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -64.76 -40.48 95.36 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CH2' ' OE1' ' A' ' 50' ' ' GLU . 34.9 t90 -59.99 -41.72 92.64 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.406 -0.809 . . . . 0.01 109.327 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.3 -45.07 99.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 120.972 -1.08 . . . . 0.0 108.425 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 78.6 p -70.42 -39.52 74.37 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.668 -1.27 . . . . 0.0 108.138 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.87 -44.91 65.37 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.476 -0.765 . . . . 0.01 111.331 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.477 ' OE1' ' CH2' ' A' ' 46' ' ' TRP . 16.0 pt-20 -60.04 -40.61 89.98 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.566 -1.334 . . . . 0.01 108.85 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -60.33 -40.05 89.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -60.84 -39.54 89.47 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.592 -0.892 . . . . 0.01 108.592 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.606 ' HZ1' ' CD ' ' A' ' 107' ' ' GLN . 89.6 mttt -69.14 -31.65 70.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.648 -0.657 . . . . 0.01 111.771 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -84.61 -15.93 43.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.44 -1.413 . . . . 0.01 110.631 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -75.39 117.68 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.846 -1.159 . . . . 0.01 108.515 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -95.04 0.05 54.13 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.01 108.887 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.4 m -96.96 110.51 54.09 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.01 108.982 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.04 -8.36 23.37 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 CA-C-N 120.073 1.062 . . . . 0.01 111.723 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -84.5 -23.74 29.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.31 -0.869 . . . . 0.01 109.57 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -90.16 -18.63 25.42 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.968 -1.083 . . . . 0.01 109.533 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.18 -39.98 92.18 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.173 -0.954 . . . . 0.01 109.152 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.52 -65.01 1.0 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.515 -0.741 . . . . 0.01 111.484 -179.168 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.4 Cg_exo -40.15 -61.38 0.46 Allowed 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 121.0 1.133 . . . . 0.01 113.209 -179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -71.52 -26.88 62.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.885 -1.134 . . . . 0.01 110.525 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 69' ' ' TYR . . . -59.04 -50.02 75.68 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.761 -1.212 . . . . 0.01 108.737 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -61.77 -45.09 95.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.145 -0.972 . . . . 0.01 109.341 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.41 -47.29 79.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.287 -0.883 . . . . 0.01 108.939 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.62 -45.99 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.452 -0.78 . . . . 0.01 109.115 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.639 ' CE2' HG21 ' A' ' 73' ' ' ILE . 64.6 t80 -60.13 -49.92 75.74 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.697 0.761 . . . . 0.01 109.419 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.66 -39.68 92.22 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.087 -1.008 . . . . 0.01 109.501 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -79.38 -62.02 1.82 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.195 -0.94 . . . . 0.0 112.141 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.575 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 87.3 m-85 -84.2 -27.4 28.05 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.639 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.9 mm -100.53 -17.6 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 120.19 -1.569 . . . . 0.01 112.349 -177.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.7 t -59.42 126.06 26.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.371 -1.456 . . . . 0.01 109.675 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.439 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 4.2 m -60.77 -14.37 9.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.313 -0.867 . . . . 0.01 108.724 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -97.6 -0.13 46.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.262 -0.899 . . . . 0.01 108.601 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.96 138.47 24.63 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.365 -0.834 . . . . 0.01 109.611 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -70.12 -19.83 63.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.312 -0.868 . . . . 0.01 109.315 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.575 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 14.7 pttp -129.76 69.34 1.43 Allowed 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.696 0.76 . . . . 0.01 109.271 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 90.7 mt-10 -60.02 142.16 54.43 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.267 -0.896 . . . . 0.01 109.803 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.426 ' H ' HG22 ' A' ' 81' ' ' VAL . 3.3 m -86.39 142.05 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.303 -0.873 . . . . 0.0 109.25 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.722 HD21 HD21 ' A' ' 42' ' ' ASN . 20.4 p30 -74.42 100.39 3.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.355 -0.841 . . . . 0.0 110.076 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.1 mt -145.54 173.45 12.03 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 108.786 -0.82 . . . . 0.01 108.786 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.96 157.54 38.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.01 109.391 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 82.3 p -70.16 -20.19 63.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.175 -0.953 . . . . 0.01 109.956 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 18.6 t -84.28 -32.31 24.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.01 109.803 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.494 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 93.6 m -60.1 -41.99 93.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.037 -1.039 . . . . 0.01 109.093 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.445 HH12 HD13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -64.62 -44.96 88.89 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.01 108.926 179.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.427 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.7 mt-10 -59.99 -40.06 87.86 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -60.16 -39.96 88.24 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.791 . . . . 0.01 109.796 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.64 79.02 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.832 -1.168 . . . . 0.01 109.03 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 53.0 p -52.83 -39.57 62.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.481 -0.762 . . . . 0.01 109.552 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -61.71 -41.35 97.49 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.673 -1.232 . . . . 0.01 107.673 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -70.35 -28.09 64.85 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.857 -0.527 . . . . 0.01 110.202 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 99.0 mmm -59.99 -40.05 87.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.822 -1.174 . . . . 0.01 108.836 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 91.4 mt -67.09 -18.52 65.36 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.116 -1.068 . . . . 0.01 108.116 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -144.07 79.02 13.41 Favored Pre-proline 0 N--CA 1.493 1.724 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -56.76 111.16 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.354 0 C-N-CA 120.853 1.035 . . . . 0.01 112.595 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.4 p -124.71 173.08 8.78 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.887 -0.783 . . . . 0.01 108.887 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.434 ' O ' ' OD2' ' A' ' 104' ' ' ASP . 10.5 tp -70.82 -21.37 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.221 -0.924 . . . . 0.01 109.929 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.9 p -94.23 12.47 26.61 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 0.01 109.564 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.503 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 26.4 t -61.22 -65.89 0.62 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.37 -0.831 . . . . 0.01 110.822 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.503 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 77.8 m-85 -95.48 0.03 52.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.079 -1.013 . . . . 0.01 110.783 -178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 100' ' ' ILE . 86.9 m-20 -60.59 -39.95 89.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.724 -1.235 . . . . 0.01 109.958 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -64.3 -37.03 86.06 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.222 -0.924 . . . . 0.01 109.173 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.23 -42.8 79.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.164 -0.96 . . . . 0.0 109.985 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.606 ' CD ' ' HZ1' ' A' ' 53' ' ' LYS . 43.2 tt0 -60.01 -40.99 91.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.788 -1.195 . . . . 0.0 109.438 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -60.1 -39.95 87.95 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.436 -0.95 . . . . 0.01 108.436 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.494 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 30.0 mmtp -64.27 -37.15 86.48 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.594 -0.891 . . . . 0.01 108.594 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.97 -45.41 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.121 -0.987 . . . . 0.0 108.498 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.514 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.0 m-85 -59.97 -48.14 82.92 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -61.88 -44.18 97.32 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.19 -0.944 . . . . 0.01 109.941 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.8 tp -64.35 -56.24 15.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.176 -0.953 . . . . 0.0 110.799 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.509 ' O ' ' N ' ' A' ' 118' ' ' SER . 13.3 ptm -64.78 -40.53 95.4 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.084 -1.01 . . . . 0.0 110.029 -178.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -63.65 -41.8 98.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.976 -1.077 . . . . 0.01 109.984 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.408 ' O ' ' NE ' ' A' ' 120' ' ' ARG . 98.3 mttt -74.44 -35.21 63.34 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.395 -1.441 . . . . 0.01 111.083 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -101.77 -39.84 7.23 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.025 -1.047 . . . . 0.0 112.204 -178.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.509 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.7 p -79.94 -50.87 9.82 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.28 -1.513 . . . . 0.01 111.939 -178.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.46 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.26 -53.35 44.99 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.945 -1.097 . . . . 0.01 111.087 -178.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' A' ' 116' ' ' LYS . 86.4 mtm180 -60.0 -40.1 88.06 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.624 -1.297 . . . . 0.01 108.717 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 125' ' ' SER . 25.5 mmt-85 -70.17 -39.91 74.99 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 107.713 -1.217 . . . . 0.01 107.713 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -56.67 -57.6 11.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.522 -0.736 . . . . 0.01 110.083 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.97 -34.72 73.68 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.341 -0.85 . . . . 0.01 108.907 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -91.95 2.01 56.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.542 -0.724 . . . . 0.01 110.05 -179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.4 p -81.52 161.37 23.62 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.757 -1.214 . . . . 0.01 110.608 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 87.0 mtm180 -67.35 -39.46 85.76 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.301 0.572 . . . . 0.01 109.625 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -58.79 -52.49 65.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.01 109.746 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.924 ' CZ ' HG21 ' A' ' 132' ' ' THR . 68.4 t80 -60.07 -45.85 91.52 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.336 -0.853 . . . . 0.01 110.198 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.2 mt -60.01 -49.98 75.52 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.172 -0.955 . . . . 0.01 109.173 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -60.17 -45.23 93.83 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.918 -1.114 . . . . 3.77 108.678 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 -26.72 64.26 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.587 -0.894 . . . . 3.8700000000000001 108.587 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.924 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 40.0 p -117.12 83.02 1.91 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.559 0.695 . . . . 4.6299999999999999 109.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.456 ' H ' HE22 ' A' ' 7' ' ' GLN . 31.6 m-80 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 108.328 -0.99 . . . . 6.4800000000000004 108.328 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.44 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 40.9 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 109.17 -0.678 . . . . 18.699999999999999 109.17 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.5 p -75.85 168.54 19.84 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.32 -0.863 . . . . 15.970000000000001 109.565 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -69.94 -25.47 63.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 13.82 109.856 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.33 -40.01 89.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.869 -1.144 . . . . 15.06 111.094 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.655 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.1 mt-10 -71.43 -42.67 67.95 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.994 -1.066 . . . . 14.68 111.516 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.36 -37.36 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.793 -1.192 . . . . 11.69 109.862 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -60.04 -37.21 79.13 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.997 -1.064 . . . . 10.51 109.325 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -59.9 -39.94 87.05 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.923 -1.14 . . . . 10.82 107.923 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 33.6 m0 -59.79 -29.57 68.3 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.935 -0.765 . . . . 6.2599999999999998 108.935 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.38 -6.26 58.73 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.079 -1.013 . . . . 0.01 108.862 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -96.81 -29.25 13.85 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.357 -0.84 . . . . 0.01 111.43 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.509 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 94.2 p -169.91 143.5 2.58 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.518 -1.364 . . . . 0.01 111.318 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.566 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.2 tp -60.05 -39.9 87.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 116.027 -0.533 . . . . 0.01 109.916 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -55.92 -40.11 72.62 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.279 -0.888 . . . . 0.01 109.455 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.509 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 91.3 m-20 -61.18 -49.18 78.25 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.143 -0.973 . . . . 0.01 109.877 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.05 -46.82 88.29 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.129 -0.982 . . . . 0.01 108.897 179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.465 ' O ' HD21 ' A' ' 27' ' ' LEU . 94.4 mt -73.27 -26.58 22.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.343 -0.848 . . . . 0.01 110.326 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.3 m-20 -90.31 -0.09 57.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.793 -1.192 . . . . 0.01 110.821 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.655 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 52.9 t-80 -94.26 139.88 30.49 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.865 -1.147 . . . . 0.01 109.987 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -60.07 -40.28 88.98 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.429 -0.795 . . . . 0.01 110.165 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.44 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 15.1 t -83.73 -30.68 26.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.982 -1.074 . . . . 0.01 108.473 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.09 -49.16 81.6 Favored Glycine 0 N--CA 1.484 1.884 0 N-CA-C 108.037 -2.025 . . . . 0.01 108.037 178.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 ' O ' ' A' ' 21' ' ' ILE . 66.1 mt -59.88 -48.84 80.06 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.26 -1.141 . . . . 0.01 109.242 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -49.22 78.5 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.033 -1.042 . . . . 0.01 109.159 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -41.97 73.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.397 -0.815 . . . . 0.01 109.955 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.826 ' CE2' HD11 ' A' ' 34' ' ' LEU . 46.1 t80 -66.41 -45.88 78.45 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.397 -0.814 . . . . 0.0 110.819 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -59.7 -40.04 86.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.67 -1.269 . . . . 0.01 108.577 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.17 75.16 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.167 -1.049 . . . . 0.01 108.167 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -61.28 -42.73 99.15 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.569 -0.707 . . . . 0.01 110.24 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.826 HD11 ' CE2' ' A' ' 30' ' ' PHE . 81.4 mt -60.01 -39.79 87.0 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.104 -0.997 . . . . 0.0 108.342 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -54.39 -39.93 67.71 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.736 -1.209 . . . . 0.01 107.736 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.7 m -65.92 -20.46 66.22 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.422 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.3 mt-10 -103.47 7.13 37.9 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.529 -0.732 . . . . 0.01 109.345 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 53.23 40.14 30.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.365 -0.834 . . . . 0.01 109.71 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.513 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 5.0 t -124.52 33.01 5.34 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.05 -30.09 69.22 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.165 -0.959 . . . . 0.0 109.636 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 7.3 pm0 -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 120.574 -1.329 . . . . 0.0 108.871 179.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.712 HD21 ' ND2' ' A' ' 82' ' ' ASN . 98.5 m-20 -62.08 -44.24 97.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -0.84 . . . . 0.0 111.084 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.7 tp -69.98 -40.01 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.565 -1.334 . . . . 0.0 109.209 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -60.32 -41.42 93.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -62.74 -42.86 99.87 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -60.05 -46.38 89.71 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.897 -0.779 . . . . 0.01 108.897 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.72 -43.43 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 108.637 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.4 p -68.45 -39.87 81.3 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.3 t -64.82 -41.57 95.65 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.453 -0.78 . . . . 0.01 109.12 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -59.89 -44.84 93.99 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.233 -0.917 . . . . 0.01 109.014 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -60.28 -40.13 89.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.077 -1.014 . . . . 0.01 108.718 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -62.51 -40.04 95.45 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.134 -0.691 . . . . 0.01 109.134 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.442 ' CD ' ' OE1' ' A' ' 107' ' ' GLN . 52.9 mtpt -74.58 -17.32 60.74 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.488 -0.758 . . . . 0.01 110.934 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -92.81 -23.1 18.95 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.775 -1.203 . . . . 0.01 109.326 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 78.0 mt -73.1 122.35 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.127 -0.983 . . . . 0.01 108.559 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -100.05 1.5 42.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.404 -0.81 . . . . 0.01 110.152 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 m -96.26 110.22 51.29 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.38 -0.825 . . . . 0.01 109.328 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.2 -3.46 8.68 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 CA-C-N 120.243 1.122 . . . . 0.01 112.098 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 p -86.29 -26.75 24.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.307 -0.871 . . . . 0.01 109.805 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -92.47 -16.35 25.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.089 -1.007 . . . . 0.01 110.098 -179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.1 mt -62.57 -40.14 95.91 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.036 -1.04 . . . . 0.01 109.817 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.441 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.3 OUTLIER -53.62 -63.52 2.47 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.518 -0.739 . . . . 0.01 111.747 -178.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.2 Cg_exo -46.81 -54.06 5.41 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 120.763 0.975 . . . . 0.01 113.408 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.04 -30.14 66.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.918 -1.114 . . . . 0.01 110.463 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.54 77.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.864 -1.147 . . . . 0.01 109.115 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.06 -42.13 93.83 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.387 -0.821 . . . . 0.01 109.61 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.03 -46.98 79.04 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.154 -0.966 . . . . 0.01 109.66 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.2 mt -69.76 -47.33 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.01 109.561 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.57 ' CE2' HG21 ' A' ' 73' ' ' ILE . 62.2 t80 -59.97 -49.99 75.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.409 -0.807 . . . . 0.01 109.764 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.53 -40.09 96.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.195 -0.94 . . . . 0.01 110.147 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.604 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 85.7 tt0 -75.83 -48.09 22.97 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.227 -0.92 . . . . 0.0 112.206 -178.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -102.21 -21.2 14.42 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.822 -1.174 . . . . 0.0 114.115 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.57 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.4 mm -107.01 -37.81 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.794 0 O-C-N 120.436 -1.415 . . . . 0.01 113.054 -177.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 76' ' ' GLN . 11.4 t -58.85 136.96 57.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.183 -1.573 . . . . 0.01 110.01 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -57.76 -8.58 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.416 -0.802 . . . . 0.01 109.106 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.408 ' H ' ' C ' ' A' ' 74' ' ' SER . 91.0 mt-30 -94.89 0.95 55.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.437 -0.949 . . . . 0.01 108.437 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.604 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 136.77 19.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.669 -0.644 . . . . 0.01 110.223 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 50.8 p -70.75 -21.05 62.56 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.421 -0.955 . . . . 0.01 108.421 178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -140.99 85.83 2.0 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.986 -0.746 . . . . 0.01 108.986 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.2 147.31 51.3 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.024 -1.047 . . . . 0.01 109.585 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.547 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.9 m -103.4 152.65 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.471 -0.768 . . . . 0.0 109.071 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.712 ' ND2' HD21 ' A' ' 42' ' ' ASN . 4.5 p30 -73.66 106.82 5.58 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.056 -1.028 . . . . 0.0 109.359 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 88.3 mt -145.3 164.12 32.41 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 108.663 -0.865 . . . . 0.01 108.663 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.68 158.64 35.89 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.281 -0.887 . . . . 0.01 108.896 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 79.7 p -69.84 -20.02 63.44 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.147 -0.97 . . . . 0.01 109.087 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 25.8 p -83.6 -33.4 25.35 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.23 -0.919 . . . . 0.01 109.391 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 93.9 m -60.16 -42.96 96.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.01 109.361 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.547 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 51.5 mtt-85 -61.13 -51.8 67.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.01 108.911 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 92' ' ' SER . 98.9 mt-10 -60.59 -39.97 90.02 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.823 -0.806 . . . . 0.01 108.823 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.02 -41.01 91.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.533 -0.729 . . . . 0.01 109.266 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.6 m -64.41 -47.97 77.15 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.953 -1.092 . . . . 0.01 108.962 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 89' ' ' GLU . 62.8 p -51.28 -37.39 47.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.01 109.081 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.53 -39.97 94.75 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.437 -1.32 . . . . 0.01 107.437 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -68.02 -40.01 83.03 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.313 -0.995 . . . . 0.01 108.313 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 90.9 mmm -54.98 -30.01 58.31 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.544 -1.28 . . . . 0.01 107.544 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.1 tp -64.52 -33.85 76.85 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.46 -1.311 . . . . 0.01 107.46 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -141.15 80.43 16.88 Favored Pre-proline 0 N--CA 1.494 1.737 0 N-CA-C 108.209 -1.034 . . . . 0.01 108.209 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -52.77 115.18 2.07 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 120.986 1.124 . . . . 0.01 112.548 -178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.5 p -127.76 174.3 9.24 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.843 -0.799 . . . . 0.01 108.843 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -70.01 -19.99 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.175 -0.953 . . . . 0.01 109.787 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.9 p -94.55 10.03 36.29 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.098 -1.001 . . . . 0.01 109.434 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.04 -56.82 16.59 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.383 -0.823 . . . . 0.01 110.807 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -98.35 -0.27 44.09 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.152 -0.967 . . . . 0.01 111.325 -178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -60.56 -40.1 90.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.634 -1.291 . . . . 0.01 109.543 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -63.86 -37.56 87.84 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.386 -0.821 . . . . 0.01 109.361 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.01 -41.18 78.11 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.442 ' OE1' ' CD ' ' A' ' 53' ' ' LYS . 59.5 tt0 -60.02 -40.73 90.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.915 -1.116 . . . . 0.0 109.031 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -59.99 -40.06 87.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.64 -0.874 . . . . 0.01 108.64 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 33.0 mmtm -63.49 -39.82 95.45 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.522 -0.918 . . . . 0.01 108.522 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.12 -47.65 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.566 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.5 m-85 -59.93 -50.12 75.02 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.936 -1.103 . . . . 0.0 108.815 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -64.75 -42.33 95.25 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.118 -0.989 . . . . 0.01 109.521 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.418 ' O ' ' OD1' ' A' ' 117' ' ' ASP . 29.2 tp -64.78 -55.04 22.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.006 -1.059 . . . . 0.0 111.127 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.491 ' SD ' HD21 ' A' ' 17' ' ' LEU . 9.7 ptm -63.01 -40.63 98.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.997 . . . . 0.0 110.676 -178.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -65.05 -39.99 94.12 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.67 -1.269 . . . . 0.01 110.867 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -69.3 -39.65 78.17 Favored 'General case' 0 C--N 1.293 -1.887 0 O-C-N 120.163 -1.586 . . . . 0.01 111.409 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 118' ' ' SER . 37.5 p-10 -102.78 -30.96 10.55 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.941 -1.099 . . . . 0.0 112.26 -178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.492 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 17.0 p -85.43 -47.74 9.67 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.054 -1.654 . . . . 0.01 111.973 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.75 -50.06 69.32 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.826 -1.171 . . . . 0.01 111.496 -177.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.436 ' HG2' HH11 ' A' ' 120' ' ' ARG . 37.3 mtt-85 -60.0 -41.33 91.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.428 -1.42 . . . . 0.01 108.09 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 8.5 mpt_? -70.4 -38.12 74.6 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.2 t80 -60.04 -43.87 95.03 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.192 -0.942 . . . . 0.01 108.674 179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -37.54 80.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.205 -1.035 . . . . 0.01 108.205 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -101.06 13.82 33.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.544 -0.723 . . . . 0.01 110.428 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 3.5 t -74.26 147.57 42.27 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.884 -1.135 . . . . 0.01 110.694 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -43.22 95.79 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.01 108.706 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -59.96 -52.43 65.43 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.527 -0.916 . . . . 0.01 108.527 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.439 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 63.7 t80 -59.98 -49.56 77.18 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.573 0.701 . . . . 0.01 109.672 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -60.02 -39.95 87.6 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.527 -0.733 . . . . 0.01 109.285 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -60.03 -43.66 95.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.968 -1.083 . . . . 3.77 108.253 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.9 mt -69.96 -39.34 76.07 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.273 -1.01 . . . . 3.8700000000000001 108.273 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 7.8 p -103.51 70.4 1.03 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.923 -0.769 . . . . 4.6299999999999999 108.923 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 6.4800000000000004 108.701 179.95 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 109.275 -0.639 . . . . 18.699999999999999 109.275 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 p -71.96 159.43 34.25 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.279 -0.888 . . . . 15.970000000000001 109.365 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.96 -28.91 65.94 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.406 -0.809 . . . . 13.82 109.76 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.71 -39.19 90.96 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.041 -1.037 . . . . 15.06 111.13 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.682 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.4 mt-10 -71.83 -44.6 63.61 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.032 -1.043 . . . . 14.68 111.898 -177.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.77 HG21 HG22 ' A' ' 132' ' ' THR . 17.2 m -59.97 -35.76 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.616 -1.302 . . . . 11.69 109.769 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -60.09 -39.92 87.78 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.837 -1.164 . . . . 10.51 108.594 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.38 -40.53 91.2 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.015 -1.106 . . . . 10.82 108.015 179.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.53 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.1 m0 -59.69 -27.52 66.49 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.353 -0.98 . . . . 6.2599999999999998 108.353 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.53 -6.15 59.16 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.858 -1.151 . . . . 0.01 108.825 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -95.45 -29.95 14.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.336 -0.852 . . . . 0.01 110.741 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.495 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 34.9 p -172.44 147.64 1.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.722 -1.236 . . . . 0.01 110.629 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' CD2' ' A' ' 111' ' ' PHE . 19.0 tp -60.06 -46.45 89.53 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.713 -0.617 . . . . 0.01 110.186 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.406 ' O ' ' CG ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -46.31 -38.76 9.14 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.014 -1.054 . . . . 0.01 110.233 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -64.5 -46.4 83.14 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.848 -1.158 . . . . 0.01 111.226 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.98 -45.83 91.42 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.989 -1.07 . . . . 0.01 110.554 -179.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.1 pt -79.74 -17.2 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.167 -0.958 . . . . 0.01 110.818 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 18' ' ' GLU . 4.1 m120 -85.89 -10.77 54.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.733 -1.229 . . . . 0.01 110.001 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.682 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 30.2 t-80 -94.77 136.57 34.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.013 -1.055 . . . . 0.01 109.474 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -60.16 -40.87 91.44 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.28 -0.888 . . . . 0.01 110.877 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -82.02 -28.03 32.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.801 -1.187 . . . . 0.01 108.0 -179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.24 92.17 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 107.192 -2.363 . . . . 0.01 107.192 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.03 -44.33 94.7 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.486 -1.008 . . . . 0.01 108.416 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.98 92.31 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.593 -0.891 . . . . 0.01 108.593 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.96 62.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.441 -0.787 . . . . 0.01 108.95 179.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.716 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 54.5 t80 -60.37 -49.88 75.81 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.358 -0.839 . . . . 0.0 108.908 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -61.47 -39.83 92.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.286 -0.884 . . . . 0.01 109.405 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.86 84.49 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.211 -0.93 . . . . 0.01 109.166 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -59.99 -48.23 82.57 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.378 -0.826 . . . . 0.01 109.889 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 88.8 mt -63.12 -42.48 99.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.891 -1.131 . . . . 0.0 109.011 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -59.98 -35.78 75.75 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.774 -0.825 . . . . 0.01 108.774 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.5 m -59.66 -28.56 67.36 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.445 ' OE1' ' NH1' ' A' ' 121' ' ' ARG . 97.7 mt-10 -107.77 10.63 28.73 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.542 -0.91 . . . . 0.01 108.542 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 56.27 37.46 28.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.837 -0.539 . . . . 0.01 110.493 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.13 28.09 7.1 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -64.56 -9.96 22.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.463 -0.773 . . . . 0.0 109.139 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 22.4 pt-20 -61.92 -40.02 94.05 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 120.942 -1.098 . . . . 0.0 109.023 179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' A' ' 41' ' ' GLU . 97.9 m-20 -60.47 -50.06 75.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.516 -0.74 . . . . 0.0 111.659 -179.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tp -70.0 -39.42 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.749 -1.219 . . . . 0.0 109.525 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -59.94 -41.22 91.34 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.31 -41.61 93.88 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.506 ' CH2' ' OE2' ' A' ' 50' ' ' GLU . 44.9 t90 -59.99 -45.87 91.31 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.571 -0.706 . . . . 0.01 110.087 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 95.2 mt -59.96 -44.48 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.041 -1.037 . . . . 0.0 109.21 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -66.17 -39.39 89.7 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.553 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 3.5 t -66.49 -34.52 78.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.492 -0.755 . . . . 0.01 109.929 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.506 ' OE2' ' CH2' ' A' ' 46' ' ' TRP . 39.1 mt-10 -60.0 -47.85 84.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.831 -1.168 . . . . 0.01 108.698 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -60.19 -39.74 87.59 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.188 -1.041 . . . . 0.01 108.188 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -59.98 -38.66 83.2 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.766 -0.584 . . . . 0.01 109.443 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 52.1 mttp -76.96 -11.88 59.87 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.094 -1.004 . . . . 0.01 111.165 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -92.85 -22.93 19.0 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.525 -1.359 . . . . 0.01 109.369 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -77.58 118.82 25.09 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.276 -0.89 . . . . 0.01 109.477 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -96.91 0.03 48.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.162 -0.961 . . . . 0.01 109.287 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 75.6 m -96.43 109.93 50.22 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.581 -0.699 . . . . 0.01 109.131 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -68.88 -2.79 10.15 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.223 1.115 . . . . 0.01 111.644 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.7 p -86.05 -27.98 24.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.412 -0.805 . . . . 0.01 109.976 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -90.7 -16.75 27.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.952 -1.092 . . . . 0.01 109.823 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.69 -39.96 90.42 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.167 -0.958 . . . . 0.01 109.738 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.449 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.42 -64.41 1.42 Allowed Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.085 -1.01 . . . . 0.01 110.931 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.449 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 10.7 Cg_exo -41.44 -54.66 2.58 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 C-N-CA 120.885 1.057 . . . . 0.01 112.937 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.49 -34.46 63.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.946 -1.096 . . . . 0.01 110.55 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.63 83.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.902 -1.124 . . . . 0.01 108.879 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -59.99 -48.26 82.43 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.371 -0.831 . . . . 0.01 109.092 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -64.95 -45.36 86.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.01 109.557 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.5 mt -69.46 -44.79 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.054 -1.029 . . . . 0.01 108.604 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.5 t80 -60.41 -49.01 79.29 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.592 -0.692 . . . . 0.01 109.658 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -65.11 -40.09 94.05 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.54 -0.725 . . . . 0.01 111.133 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.687 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 94.3 mt-10 -81.39 -31.93 33.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.017 -1.052 . . . . 0.0 112.04 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.425 ' CZ ' ' NZ ' ' A' ' 79' ' ' LYS . 86.7 m-85 -111.23 -31.21 7.15 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.971 -1.08 . . . . 0.0 113.469 -177.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.496 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.6 mm -101.67 -36.87 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 120.447 -1.408 . . . . 0.01 112.671 -176.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m -58.58 139.96 55.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.383 -1.448 . . . . 0.01 110.236 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.2 m -58.99 -11.41 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 O-C-N 121.556 -0.715 . . . . 0.01 109.307 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -94.15 -3.4 51.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.297 -0.877 . . . . 0.01 108.768 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.28 130.13 22.56 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.553 -0.717 . . . . 0.01 109.244 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.1 p -70.02 -18.22 63.3 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.962 -1.125 . . . . 0.01 107.962 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.425 ' NZ ' ' CZ ' ' A' ' 72' ' ' PHE . 36.2 pttt -129.1 72.59 1.47 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.331 -0.988 . . . . 0.01 108.331 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.8 mt-10 -60.17 148.41 36.31 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.626 -0.671 . . . . 0.01 109.206 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -107.13 148.38 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.438 -0.789 . . . . 0.0 109.087 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.65 105.61 5.82 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 -179.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.1 mt -144.82 164.67 30.36 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.613 -0.884 . . . . 0.01 108.613 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -72.62 159.95 33.04 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.332 -0.855 . . . . 0.01 109.422 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.8 t -68.09 -22.63 64.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.01 109.396 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.9 m -82.29 -40.82 20.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.941 . . . . 0.01 109.795 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 97.0 m -59.95 -47.52 85.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.262 -0.898 . . . . 0.01 110.202 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -59.96 -47.39 86.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.984 -1.072 . . . . 0.01 108.893 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.21 -39.92 88.28 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.619 -0.675 . . . . 0.01 109.537 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 84.4 tt0 -59.96 -40.3 88.56 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.253 -0.904 . . . . 0.01 109.204 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -64.23 -38.89 92.68 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.21 -0.931 . . . . 0.01 108.744 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.6 p -60.05 -40.49 89.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.497 -0.752 . . . . 0.01 109.811 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 82.3 mtm180 -68.17 -36.03 78.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.01 109.447 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -64.89 -19.94 66.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.356 -0.84 . . . . 0.01 110.428 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 41.8 mmm -60.14 -31.2 69.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.97 -1.081 . . . . 0.01 109.114 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.74 -40.06 95.8 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.606 -0.887 . . . . 0.01 108.606 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -141.12 78.58 18.96 Favored Pre-proline 0 N--CA 1.493 1.68 0 N-CA-C 107.748 -1.205 . . . . 0.01 107.748 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -54.65 137.15 73.24 Favored 'Trans proline' 0 N--CA 1.488 1.192 0 C-N-CA 120.989 1.126 . . . . 0.01 112.85 -178.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.6 p -127.97 167.66 16.36 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.846 -0.798 . . . . 0.01 108.846 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.16 -20.21 21.38 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.185 -0.947 . . . . 0.01 108.853 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.4 p -97.65 3.42 50.34 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.341 -0.849 . . . . 0.01 109.962 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.441 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 3.1 t -59.04 -55.16 38.69 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.262 -0.899 . . . . 0.01 110.616 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.441 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 47.1 m-85 -92.97 -5.15 51.36 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.898 -1.126 . . . . 0.01 110.832 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -64.01 -39.95 95.25 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.754 -1.216 . . . . 0.01 108.745 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.417 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.7 tt0 -60.87 -40.03 91.43 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.904 -0.776 . . . . 0.01 108.904 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.41 81.09 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.535 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 47.2 tt0 -60.02 -39.97 87.7 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.167 -0.958 . . . . 0.0 108.474 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -60.05 -39.81 87.26 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.256 -1.016 . . . . 0.01 108.256 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 59.3 mmtt -62.91 -40.03 96.35 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.267 -0.896 . . . . 0.01 108.821 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.5 mm -66.95 -40.46 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.09 -1.006 . . . . 0.0 108.682 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.541 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.04 -57.11 14.27 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -61.19 -39.88 91.83 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.731 -0.606 . . . . 0.01 110.713 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.661 HD23 ' C ' ' A' ' 113' ' ' LEU . 6.6 tt -61.25 -60.58 3.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.96 -1.087 . . . . 0.0 109.785 -178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.521 ' O ' ' N ' ' A' ' 118' ' ' SER . 0.0 OUTLIER -70.06 -37.49 75.52 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.967 -1.083 . . . . 0.0 110.247 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.1 tt0 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.81 -1.181 . . . . 0.01 109.999 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -80.35 -11.49 59.7 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.1 -1.625 . . . . 0.01 110.072 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -123.17 -58.29 1.64 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.263 -0.898 . . . . 0.0 111.236 -178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 114' ' ' MET . 37.6 p -61.88 -44.71 96.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.802 -1.186 . . . . 0.01 111.072 -178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.53 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -56.43 -52.07 66.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.184 -0.948 . . . . 0.01 110.382 -178.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.469 ' NH1' ' CB ' ' A' ' 120' ' ' ARG . 8.8 mtp-105 -60.24 -39.97 88.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.894 -1.129 . . . . 0.01 108.228 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.461 ' O ' ' N ' ' A' ' 125' ' ' SER . 81.6 mtm180 -70.18 -35.56 74.04 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.802 -0.814 . . . . 0.01 108.802 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.493 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.7 OUTLIER -59.39 -48.39 81.82 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.609 -0.886 . . . . 0.01 108.609 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -59.92 -39.01 84.0 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.827 -0.805 . . . . 0.01 108.827 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -89.26 0.74 56.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.413 -0.804 . . . . 0.01 109.69 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.461 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.3 t -69.88 152.46 44.5 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.11 -0.994 . . . . 0.01 110.053 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.496 ' HG2' HH11 ' A' ' 126' ' ' ARG . 23.2 mtt-85 -67.08 -39.99 86.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.657 -0.652 . . . . 0.01 110.037 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.91 -42.46 94.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.196 -0.94 . . . . 0.01 109.59 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.816 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.6 t80 -59.84 -45.78 91.36 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.178 -0.951 . . . . 0.01 110.166 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.04 -50.01 75.39 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.01 109.695 -179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.479 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.9 m-20 -60.15 -44.85 94.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.138 -0.976 . . . . 3.77 109.143 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.57 -27.17 63.92 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.271 -1.011 . . . . 3.8700000000000001 108.271 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.816 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.5 p -115.15 81.57 1.6 Allowed 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.649 -0.871 . . . . 4.6299999999999999 108.649 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 39.2 m-80 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 121.323 -0.861 . . . . 6.4800000000000004 109.136 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.467 HG22 ' SG ' ' A' ' 25' ' ' CYS . 75.6 t . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.314 0.578 . . . . 18.699999999999999 109.959 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.6 p -77.97 160.99 27.85 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.448 -0.782 . . . . 15.970000000000001 109.196 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 10' ' ' VAL . 97.3 mt-30 -70.07 -31.63 69.33 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.391 -0.818 . . . . 13.82 109.583 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.26 -37.28 86.93 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 120.976 -1.077 . . . . 15.06 110.378 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -70.15 -39.98 75.03 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 14.68 112.059 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.571 HG21 HG23 ' A' ' 132' ' ' THR . 2.6 m -60.76 -28.9 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 120.448 -1.407 . . . . 11.69 110.019 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -60.03 -40.02 87.88 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.936 -1.102 . . . . 10.51 108.688 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.07 -35.06 77.52 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.796 -0.816 . . . . 10.82 108.796 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.86 -33.8 72.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.19 -0.943 . . . . 6.2599999999999998 108.89 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.59 -7.46 59.26 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.664 -1.272 . . . . 0.01 109.282 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -89.1 -30.55 18.56 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.291 -0.881 . . . . 0.01 111.335 -179.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.485 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.5 p -173.13 143.09 1.1 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.47 -1.394 . . . . 0.01 111.174 -179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.557 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.0 tp -59.99 -40.06 87.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.786 -0.571 . . . . 0.01 110.317 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.9 mt-10 -56.88 -39.6 74.68 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.122 -0.986 . . . . 0.01 109.205 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -60.85 -48.39 82.02 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.01 109.749 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.01 -46.56 89.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.883 -1.135 . . . . 0.01 108.673 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.486 ' O ' HD21 ' A' ' 27' ' ' LEU . 96.6 mt -70.05 -34.96 61.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 O-C-N 121.467 -0.771 . . . . 0.01 109.539 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.472 ' N ' ' O ' ' A' ' 18' ' ' GLU . 7.7 m120 -88.51 6.31 38.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.254 -0.904 . . . . 0.01 110.578 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.51 ' HD1' ' HE1' ' A' ' 13' ' ' TRP . 18.6 t-160 -94.7 127.55 40.75 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.773 -1.204 . . . . 0.01 109.354 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -59.9 -46.74 88.37 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.337 -0.852 . . . . 0.01 111.501 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.467 ' SG ' HG22 ' A' ' 5' ' ' VAL . 5.8 t -81.79 -30.85 32.11 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.509 -1.37 . . . . 0.01 108.088 -179.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 23' ' ' HIS . . . -65.18 -40.7 96.96 Favored Glycine 0 C--O 1.206 -1.624 0 N-CA-C 106.843 -2.503 . . . . 0.01 106.843 177.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.486 HD21 ' O ' ' A' ' 21' ' ' ILE . 19.9 mt -55.42 -41.6 73.0 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 107.488 -1.301 . . . . 0.01 107.488 177.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.91 83.95 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.542 -0.863 . . . . 0.01 108.999 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.15 -48.0 46.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.253 -0.904 . . . . 0.01 109.525 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.82 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 32.3 t80 -59.74 -49.66 76.88 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.832 -0.543 . . . . 0.0 110.301 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -60.1 -44.17 95.04 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.638 -1.289 . . . . 0.01 109.02 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.82 81.42 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -60.04 -44.78 94.41 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.494 -0.754 . . . . 0.01 110.106 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.82 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 65.7 mt -60.13 -39.96 88.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.888 -1.132 . . . . 0.0 108.571 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -57.52 -37.28 72.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.324 -0.991 . . . . 0.01 108.324 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.0 m -63.36 -29.93 71.15 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.153 -0.967 . . . . 0.0 108.56 178.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -101.14 10.0 41.36 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.959 -0.756 . . . . 0.01 108.959 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 53.84 40.97 32.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.473 -0.767 . . . . 0.01 109.756 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.7 m -120.78 30.39 6.92 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 2.8 pm0 -65.57 -23.33 66.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.015 -1.053 . . . . 0.0 109.693 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.8 pt-20 -64.21 -31.28 72.42 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.047 -1.033 . . . . 0.0 108.945 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.733 HD21 HD21 ' A' ' 82' ' ' ASN . 97.5 m-20 -59.94 -45.72 91.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -0.898 . . . . 0.0 110.369 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.546 HD13 ' HE2' ' A' ' 30' ' ' PHE . 3.5 tp -70.71 -40.03 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 120.589 -1.319 . . . . 0.0 108.818 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.96 -42.69 98.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.6 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.0 t80 -65.42 -40.15 93.0 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.676 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 50.6 t90 -60.01 -45.04 94.05 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.688 -0.633 . . . . 0.01 109.666 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.6 mt -60.18 -41.6 87.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.239 -0.913 . . . . 0.0 109.039 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.4 p -68.16 -39.91 82.49 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.08 -1.012 . . . . 0.0 108.438 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.6 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 76.1 m -68.97 -40.22 78.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.561 -0.712 . . . . 0.01 109.695 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' CG ' ' CE2' ' A' ' 46' ' ' TRP . 56.4 mm-40 -60.03 -46.91 87.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.042 -1.036 . . . . 0.01 109.363 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.99 -39.95 87.48 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.809 -1.182 . . . . 0.01 107.809 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -61.61 -41.47 97.51 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.869 -0.789 . . . . 0.01 108.869 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.8 mttp -69.97 -20.14 63.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.325 -0.859 . . . . 0.01 110.696 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.75 -30.27 23.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.872 -1.143 . . . . 0.01 109.591 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.5 mt -74.52 119.51 22.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 O-C-N 121.093 -1.004 . . . . 0.01 109.456 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -99.92 0.02 40.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.242 -0.911 . . . . 0.01 109.633 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.5 m -92.6 113.66 60.16 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.2 -0.938 . . . . 0.01 109.063 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -68.58 -3.15 10.56 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 120.247 1.124 . . . . 0.01 112.599 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -85.88 -28.67 24.23 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.118 -0.989 . . . . 0.01 109.921 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -90.3 -16.74 28.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.013 -1.055 . . . . 0.01 110.051 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 76.8 mt -63.33 -39.33 94.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.028 -1.045 . . . . 0.01 109.134 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.455 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -51.11 -64.3 1.44 Allowed Pre-proline 0 C--N 1.3 -1.549 0 O-C-N 121.112 -0.993 . . . . 0.01 110.944 -179.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 5.0 Cg_exo -45.3 -56.61 2.63 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 120.897 1.064 . . . . 0.01 113.189 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' NZ ' HD11 ' A' ' 68' ' ' ILE . 10.9 ptmm? -70.7 -30.86 67.54 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.022 -1.048 . . . . 0.01 109.72 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -48.66 80.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.961 -1.087 . . . . 0.01 108.595 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.98 -44.39 94.51 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.562 -0.711 . . . . 0.01 109.475 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -64.89 -46.97 79.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.195 -0.94 . . . . 0.01 109.635 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.42 HD11 ' NZ ' ' A' ' 64' ' ' LYS . 96.5 mt -69.88 -45.09 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.01 110.113 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.614 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 56.9 t80 -60.67 -49.99 75.31 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.029 -1.044 . . . . 0.01 109.321 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.403 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.9 m-20 -60.44 -38.03 82.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.543 -0.723 . . . . 0.01 110.106 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -79.96 -65.69 0.97 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.194 -0.941 . . . . 0.0 112.23 -178.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CE2' ' NZ ' ' A' ' 79' ' ' LYS . 95.5 m-85 -83.21 -28.13 29.48 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.555 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -96.64 -14.33 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.506 0 O-C-N 120.211 -1.556 . . . . 0.01 111.765 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 17.2 m -60.06 125.35 23.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.486 -1.384 . . . . 0.01 109.2 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.3 m -60.46 -14.51 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.08 -1.013 . . . . 0.01 108.459 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -97.29 -1.11 45.39 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 109.066 -0.716 . . . . 0.01 109.066 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.08 141.5 13.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.314 -0.866 . . . . 0.01 109.534 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 61.8 p -69.99 -17.66 63.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.241 -0.912 . . . . 0.01 108.896 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.438 ' NZ ' ' CE2' ' A' ' 72' ' ' PHE . 17.8 pttp -134.15 68.99 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.902 -0.777 . . . . 0.01 108.902 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 44.7 mt-10 -59.64 139.98 56.77 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.104 -0.998 . . . . 0.01 109.145 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.489 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.4 m -91.06 154.54 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.314 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.733 HD21 HD21 ' A' ' 42' ' ' ASN . 5.2 p30 -75.54 107.2 7.52 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.25 -0.906 . . . . 0.0 109.21 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 85.0 mt -145.21 163.65 33.75 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.901 -0.777 . . . . 0.01 108.901 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 85' ' ' SER . 57.0 t0 -70.01 150.32 46.78 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.551 -0.907 . . . . 0.01 108.551 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.525 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 41.2 t -66.38 -23.4 66.32 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.01 108.906 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 17.4 t -84.1 -38.82 20.27 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.319 -0.863 . . . . 0.01 109.372 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.0 m -59.93 -42.6 94.31 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.159 -0.963 . . . . 0.01 109.306 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.489 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.3 mtt180 -60.17 -49.84 76.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.01 108.505 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.1 -39.83 87.53 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.296 -1.002 . . . . 0.01 108.296 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -59.95 -39.93 87.28 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.382 -0.824 . . . . 0.01 108.996 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.0 m -59.96 -40.03 87.66 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.158 -0.964 . . . . 0.01 108.623 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.1 p -59.87 -40.03 87.25 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.275 -0.891 . . . . 0.01 108.655 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.442 ' HG2' HH11 ' A' ' 93' ' ' ARG . 19.7 mmt-85 -65.2 -39.98 93.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.083 -1.08 . . . . 0.01 108.083 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.41 ' O ' ' C ' ' A' ' 97' ' ' GLU . 32.7 m120 -64.96 -35.58 81.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.668 -0.645 . . . . 0.01 109.504 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.614 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 84.4 mtp -59.97 -36.1 76.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.31 -0.869 . . . . 0.01 109.755 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -65.15 -25.14 67.61 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.721 -1.215 . . . . 0.01 107.721 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 94' ' ' ASN . 41.3 mt-10 -136.86 78.6 41.42 Favored Pre-proline 0 N--CA 1.492 1.673 0 N-CA-C 107.046 -1.464 . . . . 0.01 107.046 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -56.61 114.97 2.15 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 120.986 1.124 . . . . 0.01 113.118 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.1 p -126.77 170.11 12.5 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -70.09 -19.84 22.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.247 -0.908 . . . . 0.01 109.582 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -93.9 9.93 35.36 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.054 -1.029 . . . . 0.01 110.165 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 35.2 t -60.39 -61.68 2.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.01 110.935 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.19 -3.9 53.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.012 -1.055 . . . . 0.01 111.24 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -60.11 -40.0 88.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.01 108.427 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -61.82 -40.03 93.86 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.543 -0.723 . . . . 0.01 110.04 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.32 -46.75 72.58 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.859 -1.15 . . . . 0.0 108.969 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.676 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 52.8 tt0 -60.12 -38.45 83.09 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.321 -0.862 . . . . 0.0 109.123 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -57.74 -41.28 81.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.332 -0.855 . . . . 0.01 108.718 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -64.9 -39.78 94.07 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CD1' ' OD1' ' A' ' 82' ' ' ASN . 41.1 mm -67.99 -45.48 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.33 -0.856 . . . . 0.0 108.748 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.557 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.49 -49.4 77.69 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -63.2 -40.07 96.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.092 -1.005 . . . . 0.01 109.653 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.4 tt -64.54 -58.68 5.71 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 109.907 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.54 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.8 ptm -65.23 -40.24 93.79 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.298 -0.877 . . . . 0.0 109.96 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -60.84 -41.27 95.48 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.759 -1.213 . . . . 0.01 109.844 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -78.04 -17.41 57.08 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 120.97 -1.081 . . . . 0.01 110.753 -179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -121.28 -55.83 1.93 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.312 -0.868 . . . . 0.0 111.139 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.54 ' N ' ' O ' ' A' ' 114' ' ' MET . 55.6 p -60.14 -49.99 75.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.769 -1.207 . . . . 0.01 110.823 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -60.11 -50.19 74.67 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.209 -0.932 . . . . 0.01 111.069 -178.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.415 ' HG2' HH11 ' A' ' 120' ' ' ARG . 24.9 mmt-85 -60.1 -41.97 93.69 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.959 -1.088 . . . . 0.01 108.115 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 22.9 mmm180 -70.01 -37.19 75.6 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.441 -0.787 . . . . 0.01 109.128 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.489 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -60.01 -47.97 83.63 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.871 -1.143 . . . . 0.01 108.644 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 87.8 mt -60.18 -32.38 71.02 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.964 -1.085 . . . . 0.01 108.505 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -100.02 9.5 42.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.438 -0.789 . . . . 0.01 109.725 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 7.9 t -72.55 160.06 32.9 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.059 -1.025 . . . . 0.01 110.591 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.431 ' HG2' HH11 ' A' ' 126' ' ' ARG . 25.3 mmt-85 -70.28 -39.96 74.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.564 -0.71 . . . . 0.01 109.556 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -67.23 -46.01 75.07 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.098 -1.001 . . . . 0.01 108.747 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 122' ' ' PHE . 50.7 t80 -60.08 -50.0 75.43 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.673 -0.642 . . . . 0.01 111.013 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -58.97 -47.64 84.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.01 109.672 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.18 -40.03 88.57 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.068 -1.053 . . . . 3.77 108.614 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.02 -39.89 75.55 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.633 -0.877 . . . . 3.8700000000000001 108.633 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.571 HG23 HG21 ' A' ' 10' ' ' VAL . 9.3 p -104.75 78.82 1.47 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.943 -0.762 . . . . 4.6299999999999999 108.943 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 . . . . . 0 C--N 1.294 -1.836 0 N-CA-C 107.469 -1.308 . . . . 6.4800000000000004 107.469 179.094 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 107.726 -1.213 . . . . 18.699999999999999 107.726 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 85.7 p -74.95 160.57 30.41 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.079 -1.013 . . . . 15.970000000000001 110.172 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.457 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 27.1 mp0 -60.46 -38.97 85.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.536 -0.727 . . . . 13.82 109.398 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.99 -39.29 85.22 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.326 -0.859 . . . . 15.06 111.243 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -65.74 -52.04 54.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.858 -1.151 . . . . 14.68 110.018 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.1 m -60.32 -35.7 64.09 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.11 -0.994 . . . . 11.69 108.48 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -60.02 -38.21 82.01 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.742 -1.224 . . . . 10.51 108.472 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.94 -29.57 70.51 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.203 -0.936 . . . . 10.82 108.864 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.531 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.2 m0 -59.91 -38.72 83.14 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.944 -1.098 . . . . 6.2599999999999998 108.41 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.96 54.4 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 120.723 -1.236 . . . . 0.01 109.381 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -91.92 -31.54 15.61 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.108 -0.995 . . . . 0.01 111.093 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.509 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 37.5 p -172.13 144.37 1.64 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.598 -1.314 . . . . 0.01 111.198 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.81 HD23 ' CD2' ' A' ' 111' ' ' PHE . 56.1 tp -60.03 -39.96 87.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.242 -0.436 . . . . 0.01 110.022 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -54.85 -40.1 69.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.045 -1.035 . . . . 0.01 110.146 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.41 -40.9 98.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.908 -1.12 . . . . 0.01 109.693 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.59 -41.2 98.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.01 109.306 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.456 ' O ' HD21 ' A' ' 27' ' ' LEU . 76.5 mt -78.44 -30.05 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.376 -0.828 . . . . 0.01 110.222 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -88.09 -1.96 58.32 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.259 -0.9 . . . . 0.01 110.904 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.0 OUTLIER -92.28 135.55 33.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.944 -1.097 . . . . 0.01 109.272 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.474 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 88.5 tt0 -59.61 -37.63 79.13 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.535 -0.728 . . . . 0.01 109.309 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.68 -33.5 27.67 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.173 -0.955 . . . . 0.01 108.498 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.94 -45.31 96.1 Favored Glycine 0 C--O 1.204 -1.742 0 N-CA-C 107.616 -2.193 . . . . 0.01 107.616 178.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 21' ' ' ILE . 80.5 mt -59.77 -50.27 74.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.407 -1.055 . . . . 0.01 109.126 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.04 -49.71 76.59 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.227 -0.921 . . . . 0.01 109.39 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 33' ' ' PHE . . . -69.64 -43.31 72.91 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.334 -0.854 . . . . 0.01 109.654 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.776 ' CE2' HD11 ' A' ' 34' ' ' LEU . 60.0 t80 -60.07 -49.4 77.79 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.435 -0.79 . . . . 0.0 110.474 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -59.85 -41.62 91.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.064 -1.023 . . . . 0.01 108.504 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.5 -38.57 77.67 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.741 -1.207 . . . . 0.01 107.741 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.606 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 50.1 t80 -59.95 -44.85 94.15 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.698 -0.626 . . . . 0.01 109.979 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.776 HD11 ' CE2' ' A' ' 30' ' ' PHE . 84.7 mt -59.98 -39.94 87.4 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -56.22 -39.98 73.35 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.82 -1.178 . . . . 0.01 107.82 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.5 m -61.59 -28.21 69.19 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -104.31 6.25 35.14 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.856 -0.794 . . . . 0.01 108.856 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.503 ' N ' ' O ' ' A' ' 34' ' ' LEU . 72.4 m-85 52.85 39.89 29.78 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.486 -0.759 . . . . 0.01 109.876 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.525 ' OG ' ' ND2' ' A' ' 42' ' ' ASN . 1.2 t -121.12 37.58 4.29 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -69.03 -22.67 64.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.189 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 15.4 pm0 -64.54 -29.95 70.98 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.783 -1.198 . . . . 0.0 108.382 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.705 HD21 HD21 ' A' ' 82' ' ' ASN . 99.2 m-20 -60.66 -47.0 88.21 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.377 -0.827 . . . . 0.0 110.812 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.12 -39.83 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.44 -1.413 . . . . 0.0 108.339 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -62.53 -40.55 97.15 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.606 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 83.7 t80 -65.39 -39.97 92.88 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 89.6 t90 -60.16 -40.87 91.4 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.168 -0.679 . . . . 0.01 109.168 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.1 mt -62.88 -40.12 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.4 p -67.74 -40.08 84.2 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.315 -0.866 . . . . 0.0 109.095 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.606 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 27.7 m -66.87 -44.22 81.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.01 109.573 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -59.49 -46.59 88.37 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.266 -0.896 . . . . 0.01 108.687 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.08 -40.03 88.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.419 -1.326 . . . . 0.01 107.419 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -65.49 -41.69 92.98 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.209 -0.663 . . . . 0.01 109.209 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.528 ' NZ ' ' OD1' ' A' ' 104' ' ' ASP . 51.4 mttm -69.97 -21.65 63.22 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.359 -0.838 . . . . 0.01 110.918 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -85.95 -27.66 24.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.833 -1.167 . . . . 0.01 109.645 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.6 mt -71.97 117.61 15.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.133 -0.98 . . . . 0.01 108.576 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -98.79 0.89 45.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.33 -0.856 . . . . 0.01 109.047 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.5 m -95.53 110.84 53.09 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.731 -0.84 . . . . 0.01 108.731 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -70.1 0.26 6.16 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 CA-C-N 120.106 1.074 . . . . 0.01 111.641 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 90.4 p -85.95 -29.77 23.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.393 -0.817 . . . . 0.01 110.421 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -92.41 -13.69 29.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.734 -1.229 . . . . 0.01 110.247 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 84.0 mt -62.21 -39.94 94.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.908 -1.12 . . . . 0.01 109.726 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.67 -64.96 1.13 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.184 -0.948 . . . . 0.01 111.665 -179.193 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 4.7 Cg_exo -42.25 -60.93 0.6 Allowed 'Trans proline' 0 N--CA 1.49 1.324 0 C-N-CA 120.986 1.124 . . . . 0.01 113.21 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -72.64 -25.29 61.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.01 110.645 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.17 -49.18 78.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.659 -1.275 . . . . 0.01 109.068 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.52 -43.58 98.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.01 109.323 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.03 -48.0 83.78 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.235 -0.916 . . . . 0.01 108.882 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -66.18 -50.74 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.797 -0.816 . . . . 0.01 108.797 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CE2' HG21 ' A' ' 73' ' ' ILE . 46.4 t80 -60.59 -49.67 76.62 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.675 -0.641 . . . . 0.01 110.19 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -61.99 -39.98 94.06 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.313 -0.867 . . . . 0.01 109.871 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.66 -57.09 4.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.811 -1.181 . . . . 0.0 111.532 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' CE ' ' A' ' 79' ' ' LYS . 96.0 m-85 -85.68 -33.4 21.56 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.921 -1.112 . . . . 0.0 113.696 -176.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.541 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.2 mm -100.04 -10.01 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 O-C-N 120.369 -1.457 . . . . 0.01 113.049 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.8 t -61.22 130.55 46.76 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.014 -1.679 . . . . 0.01 109.098 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.429 ' H ' HG22 ' A' ' 75' ' ' VAL . 3.3 m -59.89 -17.57 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.16 -0.962 . . . . 0.01 109.404 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -99.42 -0.96 39.82 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.145 -0.972 . . . . 0.01 109.549 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.79 133.51 31.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.146 -0.971 . . . . 0.01 109.435 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.9 p -70.14 -19.79 63.2 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.023 -1.048 . . . . 0.01 108.297 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.419 ' CE ' ' CE2' ' A' ' 72' ' ' PHE . 15.0 ptmt -121.71 66.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.336 0.589 . . . . 0.01 109.623 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 98.9 mt-10 -65.19 152.56 43.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.109 -0.994 . . . . 0.01 109.757 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.74 144.61 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.441 -0.787 . . . . 0.0 108.936 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.705 HD21 HD21 ' A' ' 42' ' ' ASN . 5.5 p30 -74.37 110.73 8.9 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.434 -0.791 . . . . 0.0 109.937 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 86.4 mt -145.8 169.87 17.66 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.868 -0.79 . . . . 0.01 108.868 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -71.14 160.13 33.43 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.24 -0.912 . . . . 0.01 108.917 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.3 p -68.18 -21.34 64.89 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.157 -0.964 . . . . 0.01 109.398 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.6 m -89.34 -36.43 15.53 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.23 -0.919 . . . . 0.01 110.111 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.547 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 89.9 m -59.95 -44.24 94.52 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.199 -0.938 . . . . 0.01 110.494 -178.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -64.31 -40.13 95.3 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.896 -1.127 . . . . 0.01 109.092 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.12 -39.96 88.09 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.309 -0.869 . . . . 0.01 109.113 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.96 -40.15 88.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.26 -0.9 . . . . 0.01 109.52 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.6 m -63.61 -42.44 98.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 118.906 -1.118 . . . . 0.01 108.539 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -59.98 -39.86 87.16 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.671 0.748 . . . . 0.01 109.167 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -67.47 -38.2 84.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.368 -0.832 . . . . 0.01 109.669 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -64.94 -20.56 66.53 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.319 -0.863 . . . . 0.01 110.717 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 44.4 mmm -59.95 -34.53 73.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.834 -1.166 . . . . 0.01 108.223 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -66.53 -30.68 71.05 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.427 -0.953 . . . . 0.01 108.427 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -141.28 78.83 18.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.511 -0.922 . . . . 0.01 108.511 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -61.56 114.11 2.1 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 120.951 1.101 . . . . 0.01 112.079 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 68.8 p -125.66 177.93 5.96 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.811 -0.811 . . . . 0.01 108.811 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.7 tp -70.75 -18.78 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.381 -0.824 . . . . 0.01 109.534 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.454 ' O ' ' OE1' ' A' ' 105' ' ' GLU . 71.9 p -92.75 10.01 32.64 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.114 -0.991 . . . . 0.01 109.541 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.97 -61.33 2.47 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.105 -0.997 . . . . 0.01 111.177 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -95.46 -0.69 52.04 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.091 -1.005 . . . . 0.01 111.133 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.528 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 91.8 m-20 -59.91 -40.1 87.68 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.783 -1.198 . . . . 0.01 109.569 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.482 ' OE1' ' N ' ' A' ' 105' ' ' GLU . 57.4 mp0 -63.37 -38.09 89.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.405 -0.809 . . . . 0.01 109.215 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.42 -52.74 29.46 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.402 -0.812 . . . . 0.0 109.625 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -60.09 -41.49 92.59 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.033 -1.042 . . . . 0.0 109.316 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.14 -42.31 94.59 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.146 -0.971 . . . . 0.01 108.834 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.547 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 27.9 mmtp -67.94 -33.68 75.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.01 109.091 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 18.9 mm -66.37 -41.59 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.81 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.85 -49.51 77.42 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -62.1 -40.03 94.49 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.355 0.597 . . . . 0.01 109.785 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.0 -58.9 6.55 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.034 -1.041 . . . . 0.0 110.435 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.55 -39.41 81.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.858 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.92 -39.96 87.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.969 -1.082 . . . . 0.01 109.539 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.84 -40.14 76.0 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.453 -1.405 . . . . 0.01 111.165 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -110.71 -45.94 3.43 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.988 -1.07 . . . . 0.0 112.171 -178.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.507 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.6 p -59.97 -48.73 80.52 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.39 -1.444 . . . . 0.01 110.354 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.531 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.73 -50.36 74.12 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.134 -0.979 . . . . 0.01 109.888 -179.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.5 ' HG2' HH11 ' A' ' 120' ' ' ARG . 15.5 mtt-85 -60.59 -40.16 90.73 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.407 -0.96 . . . . 0.01 108.407 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 125' ' ' SER . 20.9 mmm180 -70.18 -40.11 74.84 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.32 -0.862 . . . . 0.01 109.309 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.606 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -58.57 -49.69 76.52 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.271 -0.893 . . . . 0.01 109.641 -179.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.1 -36.65 77.88 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -88.8 -3.32 58.79 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.539 -0.726 . . . . 0.01 109.36 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.0 p -80.1 168.67 18.85 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.159 -0.963 . . . . 0.01 109.998 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -69.71 -38.01 76.76 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.553 -0.717 . . . . 0.01 110.307 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -55.43 -59.44 4.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.918 -1.114 . . . . 0.01 110.36 -178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.516 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 59.4 t80 -61.36 -49.94 74.91 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.057 -1.027 . . . . 0.01 109.886 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.3 -46.6 89.3 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.146 -0.971 . . . . 0.01 109.57 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -59.94 -49.77 76.37 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.026 -1.046 . . . . 3.77 109.258 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.9 -39.97 75.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.856 -0.794 . . . . 3.8700000000000001 108.856 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.516 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 30.1 p -116.76 80.42 1.47 Allowed 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.582 0.706 . . . . 4.6299999999999999 109.348 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 . . . . . 0 C--N 1.296 -1.756 0 N-CA-C 108.757 -0.831 . . . . 6.4800000000000004 108.757 179.367 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.0 t . . . . . 0 N--CA 1.5 2.043 0 N-CA-C 109.086 -0.709 . . . . 18.699999999999999 109.086 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.5 p -72.91 159.09 34.26 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.465 -0.772 . . . . 15.970000000000001 109.121 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.19 -39.11 92.42 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.387 -0.821 . . . . 13.82 110.407 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.75 -37.54 86.99 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.085 -1.009 . . . . 15.06 111.164 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.861 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.7 mt-10 -69.73 -43.13 72.93 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 14.68 110.416 -177.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 m -64.55 -34.75 71.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.9 -1.125 . . . . 11.69 109.424 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -59.69 -39.44 84.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.947 -1.096 . . . . 10.51 109.042 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.36 -39.89 92.28 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 10.82 108.462 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 39.8 m0 -57.08 -22.65 41.0 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.37 -0.974 . . . . 6.2599999999999998 108.37 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.63 -11.01 54.94 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.908 -1.12 . . . . 0.01 108.015 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.23 -28.74 14.87 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.514 -0.741 . . . . 0.01 110.824 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 11.4 p -173.0 145.45 1.37 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.437 -1.414 . . . . 0.01 111.762 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.1 tp -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.841 -0.537 . . . . 0.01 110.69 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' ASN . 93.9 mt-10 -53.42 -39.18 64.13 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.077 -1.015 . . . . 0.01 109.431 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 12.3 m120 -60.95 -48.47 81.66 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.998 -1.064 . . . . 0.01 109.991 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.7 tp -60.04 -49.78 76.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.11 -0.994 . . . . 0.01 108.886 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 98.2 mt -68.41 -27.92 38.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.502 -0.749 . . . . 0.01 109.528 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLU . 89.6 m-20 -85.68 -1.32 57.05 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.019 -1.05 . . . . 0.01 109.966 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.861 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 49.4 t-80 -92.98 139.26 30.7 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.931 -1.106 . . . . 0.01 109.624 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -61.61 -40.48 94.97 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.235 -0.916 . . . . 0.01 109.581 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 11.0 t -83.66 -29.6 27.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.101 -0.999 . . . . 0.01 109.139 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.93 -44.82 97.67 Favored Glycine 0 N--CA 1.486 1.981 0 N-CA-C 107.296 -2.322 . . . . 0.01 107.296 177.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.7 mt -60.03 -51.14 70.93 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.268 -1.136 . . . . 0.01 108.916 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.64 -48.22 82.77 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.295 -0.878 . . . . 0.01 109.505 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.7 68.75 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.426 -0.796 . . . . 0.01 109.896 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.1 t80 -60.52 -47.23 87.05 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.339 -0.851 . . . . 0.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -60.15 -40.64 90.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.878 -1.139 . . . . 0.01 109.569 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.36 -42.46 75.21 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.147 -0.971 . . . . 0.01 108.525 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -59.98 -46.05 90.69 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.411 0.624 . . . . 0.01 109.586 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' A' ' 30' ' ' PHE . 52.5 mt -60.59 -39.41 87.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.099 -1.001 . . . . 0.0 109.224 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -54.22 -39.64 66.91 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 107.837 -1.172 . . . . 0.01 107.837 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -62.55 -23.29 66.91 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 34' ' ' LEU . 98.3 mt-10 -105.07 3.1 30.08 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.943 -0.762 . . . . 0.01 108.943 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 59.05 30.51 20.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.435 0.636 . . . . 0.01 109.812 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.482 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.3 OUTLIER -107.81 20.95 18.12 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -64.17 -28.96 70.11 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.861 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE2' ' O ' ' A' ' 80' ' ' GLU . 20.5 pt-20 -61.31 -33.67 73.97 Favored 'General case' 0 C--N 1.294 -1.816 0 O-C-N 120.641 -1.287 . . . . 0.0 108.688 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 82' ' ' ASN . 16.0 m120 -61.5 -41.22 96.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.422 -0.799 . . . . 0.0 111.553 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.9 tp -69.94 -37.84 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.424 -1.422 . . . . 0.0 108.527 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.8 -40.11 87.28 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -63.84 -41.38 97.83 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.539 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 56.9 t90 -60.85 -45.57 93.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.619 -0.676 . . . . 0.01 109.732 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.54 -40.24 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.254 -0.904 . . . . 0.0 109.356 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.9 p -68.8 -39.73 79.96 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.21 -0.931 . . . . 0.0 108.781 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.447 ' HG ' ' HE2' ' A' ' 53' ' ' LYS . 10.7 t -66.04 -35.52 80.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.255 -0.903 . . . . 0.01 109.634 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.539 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 37.9 mt-10 -60.07 -47.87 84.06 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.995 -1.066 . . . . 0.01 108.311 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -60.87 -39.94 91.08 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.87 -1.159 . . . . 0.01 107.87 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.1 t80 -61.0 -42.15 97.89 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.624 -0.88 . . . . 0.01 108.624 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 57.9 mttm -70.01 -21.39 63.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.327 -0.858 . . . . 0.01 110.721 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -86.64 -25.34 24.93 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.791 -1.193 . . . . 0.01 108.875 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.0 mt -77.42 113.9 17.17 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.294 -0.879 . . . . 0.01 108.788 178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -98.22 1.69 47.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.334 -0.854 . . . . 0.01 109.292 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -92.95 112.26 55.2 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 108.931 -0.766 . . . . 0.01 108.931 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.44 -11.76 32.88 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.186 1.102 . . . . 0.01 112.118 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.1 p -84.66 -17.79 37.43 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.01 109.787 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -96.44 -21.31 17.82 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.169 -0.957 . . . . 0.01 109.946 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.24 -39.88 95.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.96 -1.088 . . . . 0.01 109.437 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.96 -64.34 1.3 Allowed Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.426 -0.797 . . . . 0.01 111.226 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 11.7 Cg_exo -40.17 -62.25 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 120.976 1.117 . . . . 0.01 113.249 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -74.06 -28.13 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.133 -0.98 . . . . 0.01 111.095 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.1 87.2 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.569 -1.332 . . . . 0.01 108.683 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.423 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 98.7 mttt -60.75 -43.73 97.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.205 -0.934 . . . . 0.01 108.86 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -63.7 -48.29 77.7 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.387 -0.968 . . . . 0.01 108.387 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.97 -49.26 75.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 108.809 -0.812 . . . . 0.01 108.809 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.547 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.3 t80 -61.08 -50.01 75.03 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.434 -0.791 . . . . 0.01 110.311 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 66' ' ' LYS . 22.7 m120 -62.63 -32.96 74.09 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.951 -1.093 . . . . 0.01 109.238 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -80.0 -70.1 0.54 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.299 -0.876 . . . . 0.0 112.386 -178.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.547 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.7 mm -100.83 -13.17 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.529 -1.357 . . . . 0.01 111.754 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 23.1 p -62.37 131.59 49.77 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.604 -1.31 . . . . 0.01 110.016 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.4 m -61.48 -14.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.01 108.676 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -98.35 1.26 46.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.396 -0.815 . . . . 0.01 108.981 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.08 135.96 19.84 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.373 -0.829 . . . . 0.01 109.901 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -71.4 -18.18 62.36 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -132.83 74.19 1.56 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.609 0.718 . . . . 0.01 109.234 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 41' ' ' GLU . 94.2 mt-10 -60.03 140.07 57.04 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.301 -0.875 . . . . 0.01 109.468 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 2.6 m -90.17 155.2 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.147 -0.971 . . . . 0.0 108.492 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.612 ' ND2' ' ND2' ' A' ' 42' ' ' ASN . 0.1 OUTLIER -74.83 98.69 3.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.986 -1.071 . . . . 0.0 109.7 -179.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.7 mt -142.75 162.44 35.47 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.402 -0.811 . . . . 0.01 109.15 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.466 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 95.8 m-20 -69.95 157.14 38.03 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.275 -0.891 . . . . 0.01 108.815 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 92.6 p -69.07 -21.75 64.05 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.496 -0.752 . . . . 0.01 109.42 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 13.3 t -83.78 -35.68 24.14 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.251 -0.906 . . . . 0.01 109.035 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.428 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.5 m -60.28 -46.74 88.77 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.375 -0.828 . . . . 0.01 109.719 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.417 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.61 -51.01 71.21 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.954 -1.091 . . . . 0.01 109.244 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.3 -40.0 92.55 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 121.828 0.823 . . . . 0.01 108.838 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.427 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 85.9 tt0 -59.23 -39.99 84.5 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.922 -0.711 . . . . 0.01 109.155 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.44 ' O ' ' N ' ' A' ' 95' ' ' MET . 2.5 m -61.29 -45.94 92.38 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.878 -1.129 . . . . 0.01 108.299 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 54.7 p -50.63 -36.89 37.56 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.833 -0.803 . . . . 0.01 108.833 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -65.85 -42.99 89.75 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.071 -1.455 . . . . 0.01 107.071 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -69.93 -25.84 63.85 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 109.356 -0.609 . . . . 0.01 109.356 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.44 ' N ' ' O ' ' A' ' 91' ' ' THR . 97.9 mmm -60.33 -38.95 85.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.077 -1.014 . . . . 0.01 108.59 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -65.3 -29.21 69.95 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.031 -1.1 . . . . 0.01 108.031 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -137.49 78.24 38.56 Favored Pre-proline 0 N--CA 1.493 1.722 0 N-CA-C 107.952 -1.129 . . . . 0.01 107.952 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -59.84 122.89 12.15 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.222 1.281 . . . . 0.01 112.693 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.2 p -126.74 170.23 12.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.035 -1.098 . . . . 0.01 108.035 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -69.81 -20.15 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.045 -1.034 . . . . 0.01 109.045 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 79.2 p -94.23 6.02 49.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.334 -0.854 . . . . 0.01 109.327 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.584 ' SG ' ' CE1' ' A' ' 103' ' ' PHE . 9.8 t -61.5 -61.27 2.65 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.48 -0.763 . . . . 0.01 110.834 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.584 ' CE1' ' SG ' ' A' ' 102' ' ' CYS . 39.7 m-85 -93.71 -1.01 55.73 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.941 -1.099 . . . . 0.01 110.976 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.623 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 92.0 m-20 -63.49 -40.13 96.26 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.648 -1.282 . . . . 0.01 109.238 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.427 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 87.8 tt0 -64.11 -39.21 93.54 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.374 -0.829 . . . . 0.01 109.619 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.91 -42.84 84.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.093 -1.004 . . . . 0.0 109.201 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.424 ' OE1' ' SG ' ' A' ' 49' ' ' CYS . 45.9 tt0 -61.47 -39.71 91.89 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.834 -1.166 . . . . 0.0 108.685 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -56.43 -39.83 73.74 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.245 -1.02 . . . . 0.01 108.245 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.466 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.0 mmtp -64.14 -39.7 94.59 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.999 -0.741 . . . . 0.01 108.999 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.9 mm -64.02 -46.68 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.802 . . . . 0.0 109.399 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.14 -51.88 67.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.73 -1.231 . . . . 0.0 108.513 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -60.31 -41.88 94.4 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.719 -1.238 . . . . 0.01 109.767 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tt -63.46 -54.84 30.11 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.31 -0.868 . . . . 0.0 110.236 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 7.1 ptm -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.413 -0.804 . . . . 0.0 110.548 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.99 -53.5 57.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.639 -1.288 . . . . 0.01 110.181 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -79.33 -22.89 43.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.752 -1.218 . . . . 0.01 110.511 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -92.54 -76.66 0.46 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.032 -1.043 . . . . 0.0 112.447 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 122' ' ' PHE . 84.2 p -65.45 -40.0 92.7 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.132 -0.98 . . . . 0.01 112.759 -176.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.505 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.7 -49.89 75.0 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.908 -1.12 . . . . 0.01 111.221 -177.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -60.31 -40.01 89.02 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.398 -1.439 . . . . 0.01 108.018 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' A' ' 125' ' ' SER . 59.9 mtt-85 -70.75 -36.87 73.34 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.317 -0.864 . . . . 0.01 108.969 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.6 t80 -58.33 -43.86 88.43 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.096 -1.002 . . . . 0.01 108.505 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.4 mt -62.35 -39.9 94.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.09 -1.006 . . . . 0.01 108.905 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 -0.41 57.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.42 -0.8 . . . . 0.01 109.312 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.535 ' N ' ' O ' ' A' ' 121' ' ' ARG . 81.8 p -70.65 154.33 41.97 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.905 -1.122 . . . . 0.01 110.059 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.765 ' H ' ' NE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -62.1 -39.89 94.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.593 -0.692 . . . . 0.01 110.426 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -60.08 -52.7 64.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.836 -1.165 . . . . 0.01 109.427 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.479 ' CE2' ' OG1' ' A' ' 132' ' ' THR . 65.8 t80 -61.41 -49.61 76.15 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.4 -0.813 . . . . 0.01 110.682 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 85.1 mt -60.09 -44.97 94.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.01 109.952 -178.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 80.3 m-20 -59.97 -42.83 94.99 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.991 -1.068 . . . . 3.77 108.898 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -73.1 -39.32 65.88 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.597 -0.689 . . . . 3.8700000000000001 109.379 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.479 ' OG1' ' CE2' ' A' ' 128' ' ' TYR . 40.9 p -113.63 67.24 0.67 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.496 -0.752 . . . . 4.6299999999999999 110.427 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.532 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 34.0 m120 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.002 -1.061 . . . . 6.4800000000000004 108.258 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.496 1.826 0 N-CA-C 108.543 -0.91 . . . . 18.699999999999999 108.543 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.3 p -72.17 154.35 41.1 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.952 -1.092 . . . . 15.970000000000001 108.445 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.38 -23.88 63.79 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.199 -0.938 . . . . 13.82 108.677 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.43 -40.05 95.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 15.06 111.122 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 73.6 mm-40 -70.15 -47.17 62.83 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.987 -1.07 . . . . 14.68 110.799 -178.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.446 HG23 ' N ' ' A' ' 11' ' ' LYS . 30.8 m -64.99 -39.87 87.16 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.854 -1.154 . . . . 11.69 109.027 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.446 ' N ' HG23 ' A' ' 10' ' ' VAL . 36.6 mmtm -60.06 -39.36 85.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.567 -1.271 . . . . 10.51 107.567 178.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.66 -26.38 67.77 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.408 -0.807 . . . . 10.82 109.068 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.567 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 44.5 m0 -58.72 -37.24 75.71 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.694 -1.224 . . . . 6.2599999999999998 107.694 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.16 -9.96 59.7 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 120.449 -1.407 . . . . 0.01 109.013 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.1 mm-40 -88.36 -31.48 18.88 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.287 -0.883 . . . . 0.01 110.909 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 89.3 p -171.12 144.29 2.07 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.689 -1.257 . . . . 0.01 111.127 -179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 111' ' ' PHE . 51.7 tp -59.9 -38.89 83.56 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.294 0.569 . . . . 0.01 110.235 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -54.88 -40.12 69.42 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.112 -0.992 . . . . 0.01 110.053 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.427 ' OD1' ' OG ' ' A' ' 16' ' ' SER . 17.5 m120 -64.01 -40.72 96.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.03 -1.044 . . . . 0.01 110.302 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.5 tp -59.96 -49.64 76.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.896 . . . . 0.01 109.55 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 5.3 pt -80.18 -17.04 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.325 -0.86 . . . . 0.01 110.83 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.96 -7.9 55.16 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.891 -1.131 . . . . 0.01 110.474 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.407 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 2.2 t60 -91.33 139.55 30.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.759 -1.213 . . . . 0.01 109.0 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 51.8 tp10 -59.84 -40.01 87.09 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.01 110.224 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.0 t -81.91 -29.43 32.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.886 -1.134 . . . . 0.01 108.561 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.26 -46.91 93.41 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 107.665 -2.174 . . . . 0.01 107.665 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.05 -42.18 93.91 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.365 -1.079 . . . . 0.01 108.304 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.01 -50.54 73.33 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.416 -0.803 . . . . 0.01 109.153 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.01 -48.87 56.31 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.303 -0.873 . . . . 0.01 109.22 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.854 ' CE2' HD11 ' A' ' 34' ' ' LEU . 65.4 t80 -60.01 -49.88 75.93 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.531 -0.731 . . . . 0.0 110.705 -179.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -60.0 -40.38 89.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.629 -1.294 . . . . 0.01 108.991 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.01 72.04 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.325 -0.859 . . . . 0.01 109.464 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.52 -37.38 83.53 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.818 -1.176 . . . . 0.01 109.442 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.854 HD11 ' CE2' ' A' ' 30' ' ' PHE . 83.4 mt -59.83 -40.01 87.06 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.736 -1.227 . . . . 0.0 108.16 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -59.88 -35.66 75.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.1 m -59.91 -39.06 84.13 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.314 -0.866 . . . . 0.0 109.161 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -99.73 10.01 42.09 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.435 -0.95 . . . . 0.01 108.435 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 56.0 31.48 18.07 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.372 0.606 . . . . 0.01 109.788 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -100.58 24.21 9.32 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.0 pt-20 -64.01 -23.18 67.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.729 0.776 . . . . 0.0 109.124 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 16.8 pt-20 -63.06 -32.55 73.95 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 120.896 -1.128 . . . . 0.0 108.435 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -60.55 -46.6 89.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.517 -0.739 . . . . 0.0 110.471 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.3 tp -70.0 -40.02 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.787 -1.196 . . . . 0.0 109.252 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -64.31 -42.34 96.4 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.567 -1.333 . . . . 0.0 107.467 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.597 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 62.3 t80 -63.18 -46.25 87.97 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.535 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 48.2 t90 -59.96 -41.7 92.47 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.723 -0.61 . . . . 0.01 109.683 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.28 -40.11 87.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.08 -1.012 . . . . 0.0 109.139 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 85.4 p -66.91 -38.98 87.22 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.597 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 77.9 m -67.15 -36.18 81.28 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.874 -0.517 . . . . 0.01 109.649 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 34.1 mt-10 -59.86 -41.04 90.59 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.745 -1.222 . . . . 0.01 108.128 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -60.22 -39.79 87.9 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.794 -1.187 . . . . 0.01 107.794 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.44 -40.05 89.72 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.528 -0.545 . . . . 0.01 109.528 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.06 -17.44 63.24 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.01 110.153 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -84.25 -39.9 18.7 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.958 -1.089 . . . . 0.01 109.226 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.1 mt -71.44 118.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.25 -0.906 . . . . 0.01 109.489 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -100.99 0.89 39.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.289 -0.882 . . . . 0.01 109.639 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.8 m -92.69 111.75 52.49 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.38 -0.825 . . . . 0.01 108.878 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -68.38 0.07 5.15 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.326 1.152 . . . . 0.01 112.045 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 68.9 m -87.68 -28.15 21.99 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.275 -0.89 . . . . 0.01 109.713 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -93.66 -16.95 23.78 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.985 . . . . 0.01 110.324 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.87 -39.95 91.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.988 -1.07 . . . . 0.01 109.751 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.53 -64.69 1.01 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.929 -1.107 . . . . 0.01 110.362 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 19.6 Cg_exo -39.71 -58.25 0.91 Allowed 'Trans proline' 0 N--CA 1.488 1.163 0 C-N-CA 120.819 1.012 . . . . 0.01 113.184 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.19 -31.83 62.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.03 -1.044 . . . . 0.01 110.867 -179.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.75 80.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.702 -1.249 . . . . 0.01 108.954 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.66 -41.09 98.89 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.389 -0.819 . . . . 0.01 109.797 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.31 -52.57 61.39 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.01 109.587 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.04 -48.69 87.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 O-C-N 121.374 -0.829 . . . . 0.01 108.775 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.412 ' CE2' HG21 ' A' ' 73' ' ' ILE . 61.6 t80 -60.1 -49.98 75.53 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-O 121.661 0.743 . . . . 0.01 110.03 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.4 -34.56 76.97 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.513 -0.742 . . . . 0.01 109.289 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.09 -69.64 0.58 Allowed 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.482 -0.761 . . . . 0.0 111.927 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -82.5 -27.91 31.46 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.412 HG21 ' CE2' ' A' ' 69' ' ' TYR . 45.6 mm -97.07 -15.53 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 120.283 -1.511 . . . . 0.01 111.729 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.4 p -58.45 130.28 46.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.456 -1.403 . . . . 0.01 108.903 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.8 m -60.07 -15.68 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.276 -0.89 . . . . 0.01 109.442 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -97.55 -0.03 46.62 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.235 -0.916 . . . . 0.01 108.749 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -51.67 136.76 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.539 -0.726 . . . . 0.01 109.744 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.8 p -71.62 -14.15 61.97 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.539 -0.911 . . . . 0.01 108.539 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.1 pttt -135.96 66.32 1.5 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.599 -0.688 . . . . 0.01 109.862 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 45.0 mt-10 -60.04 140.03 57.08 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.01 109.663 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.9 m -88.13 143.83 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.363 -0.835 . . . . 0.0 109.013 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.635 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -73.07 106.61 5.01 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.194 -0.941 . . . . 0.0 109.179 -179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.8 mt -145.61 167.29 23.42 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.764 -0.828 . . . . 0.01 108.764 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 3.8 p-10 -72.6 162.21 29.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.132 -0.98 . . . . 0.01 109.497 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 47.9 t -69.62 -21.78 63.54 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.49 -0.756 . . . . 0.01 110.366 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 8.6 t -81.36 -42.71 20.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.976 -1.077 . . . . 0.01 109.677 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.416 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 99.1 m -59.98 -48.6 81.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.918 . . . . 0.01 110.071 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -60.04 -49.97 75.56 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.962 -1.086 . . . . 0.01 108.875 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -60.39 -40.38 90.69 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.308 -0.87 . . . . 0.01 109.422 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 85.4 tt0 -60.01 -40.49 89.4 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.01 109.994 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.9 m -60.94 -39.97 91.49 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 120.81 -1.181 . . . . 0.01 108.593 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.5 p -60.08 -37.52 80.17 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.963 -1.086 . . . . 0.01 108.636 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.481 ' HG2' HH11 ' A' ' 93' ' ' ARG . 8.2 mmt-85 -65.04 -32.41 74.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.01 109.722 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 98' ' ' PRO . 24.3 m120 -61.75 -22.52 65.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.01 109.804 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.601 ' SD ' ' N ' ' A' ' 95' ' ' MET . 0.0 OUTLIER -59.97 -40.01 87.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.947 -1.096 . . . . 0.01 108.119 179.211 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.72 -39.73 88.13 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -141.2 76.47 21.67 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.493 -0.754 . . . . 0.01 109.076 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.445 ' N ' ' O ' ' A' ' 94' ' ' ASN . 16.6 Cg_exo -56.02 128.81 31.78 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 121.091 1.194 . . . . 0.01 112.423 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.2 p -124.12 167.21 14.54 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.958 -0.756 . . . . 0.01 108.958 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -72.49 -19.95 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.361 -0.837 . . . . 0.01 108.998 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 78.1 p -96.72 12.22 32.69 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.01 109.747 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 94' ' ' ASN . 11.2 t -58.22 -57.57 12.3 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.366 -0.834 . . . . 0.01 110.757 -179.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -93.62 -7.94 42.51 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.952 -1.093 . . . . 0.01 110.809 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -60.39 -40.04 89.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.763 -1.21 . . . . 0.01 108.61 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.438 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.3 tt0 -61.0 -37.77 83.68 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.88 -39.95 87.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.396 -0.815 . . . . 0.0 108.9 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 49' ' ' CYS . 76.2 mt-30 -59.95 -39.96 87.37 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.159 -0.963 . . . . 0.0 108.681 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -59.8 -40.7 89.24 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.948 -1.13 . . . . 0.01 107.948 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -67.39 -40.02 85.62 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.509 -0.923 . . . . 0.01 108.509 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.6 mm -66.49 -45.59 88.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 121.19 -0.944 . . . . 0.0 108.63 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.441 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.94 -50.01 75.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 108.677 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -65.11 -39.98 93.87 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.979 -1.076 . . . . 0.01 110.141 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.9 tt -63.49 -57.03 11.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.164 -0.96 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 5.9 ptm -63.29 -36.55 84.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.996 -1.065 . . . . 0.0 108.805 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -62.83 -40.04 96.19 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.378 -0.826 . . . . 0.01 109.473 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -80.79 -10.86 59.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 120.88 -1.138 . . . . 0.01 111.287 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -122.15 -64.13 1.23 Allowed 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.148 -0.97 . . . . 0.0 111.241 -178.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 82.6 p -60.11 -45.69 92.13 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.129 -0.982 . . . . 0.01 111.101 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.567 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -59.6 -53.23 60.48 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.99 -1.069 . . . . 0.01 110.196 -179.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.423 ' NH1' ' HG2' ' A' ' 120' ' ' ARG . 28.4 mmt-85 -61.05 -39.31 89.36 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.103 -1.073 . . . . 0.01 108.103 -179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.0 mmt180 -69.74 -39.05 77.0 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.482 -0.761 . . . . 0.01 109.301 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -52.75 64.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.989 -1.069 . . . . 0.01 109.211 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.9 mt -60.11 -39.97 88.06 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.371 -0.831 . . . . 0.01 109.264 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.9 mttm -82.17 -10.1 59.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.195 -0.941 . . . . 0.01 110.161 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 121' ' ' ARG . 63.6 m -83.0 168.22 17.19 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.82 -1.175 . . . . 0.01 109.766 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.827 ' HE ' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -73.9 -27.98 61.32 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.662 -0.649 . . . . 0.01 110.298 -179.714 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -56.79 -59.3 5.23 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.01 110.322 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.462 ' O ' ' OG1' ' A' ' 132' ' ' THR . 64.1 t80 -62.11 -47.53 84.19 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.863 -1.148 . . . . 0.01 109.485 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 80.0 mt -60.02 -47.14 87.09 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.358 -0.839 . . . . 0.01 109.516 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -60.01 -46.17 90.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.176 -0.953 . . . . 3.77 109.74 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 67.2 mt -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.8700000000000001 110.65 -179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 128' ' ' TYR . 16.7 p -106.88 67.88 0.72 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.169 -0.957 . . . . 4.6299999999999999 109.754 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 20.0 m120 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.17 -1.048 . . . . 6.4800000000000004 108.17 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.56 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 63.0 t . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.276 0.56 . . . . 18.699999999999999 109.938 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.2 p -70.98 153.91 42.26 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.24 -1.022 . . . . 15.970000000000001 108.24 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -69.71 -21.48 63.48 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 120.961 -1.087 . . . . 13.82 109.906 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -63.62 -39.89 95.52 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.694 -1.254 . . . . 15.06 109.196 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.0 -40.03 65.55 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.332 -0.855 . . . . 14.68 112.343 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.64 HG21 HG22 ' A' ' 132' ' ' THR . 2.5 m -59.93 -35.9 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.482 -1.386 . . . . 11.69 110.023 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -60.02 -32.96 71.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.721 -1.237 . . . . 10.51 108.038 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -60.21 -36.96 78.86 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.965 -1.124 . . . . 10.82 107.965 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.406 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 35.8 m0 -60.07 -38.42 82.81 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.084 -1.01 . . . . 6.2599999999999998 108.694 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.12 -5.71 45.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.215 -0.928 . . . . 0.01 110.071 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.464 ' HB2' HD22 ' A' ' 19' ' ' ASN . 76.6 mm-40 -85.89 -38.41 18.08 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.034 -1.041 . . . . 0.01 109.386 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.425 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 6.2 p -173.04 156.38 3.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.98 -1.075 . . . . 0.01 110.605 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.4 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.7 tp -60.04 -42.23 93.97 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.558 -0.714 . . . . 0.01 109.849 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -53.22 -39.98 64.15 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.389 -0.819 . . . . 0.01 109.414 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' HB2' ' A' ' 15' ' ' GLU . 91.5 m-20 -61.9 -44.42 96.83 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.068 -1.02 . . . . 0.01 108.939 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.23 -42.65 95.68 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.382 -0.97 . . . . 0.01 108.382 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.562 ' O ' HD21 ' A' ' 27' ' ' LEU . 90.6 mt -79.32 -26.71 12.91 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.854 -0.529 . . . . 0.01 110.436 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.515 ' N ' ' O ' ' A' ' 18' ' ' GLU . 95.1 m-20 -90.36 -0.08 57.49 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.948 -1.095 . . . . 0.01 111.329 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' A' ' 24' ' ' GLU . 1.5 t60 -92.09 140.14 29.93 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.646 -1.284 . . . . 0.01 109.082 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 85.4 tt0 -59.93 -44.19 94.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.174 -0.954 . . . . 0.01 110.748 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.56 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 9.0 t -83.01 -35.21 26.0 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.621 -1.299 . . . . 0.01 108.856 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' A' ' 30' ' ' PHE . . . -57.88 -40.03 92.52 Favored Glycine 0 N--CA 1.482 1.708 0 N-CA-C 106.576 -2.61 . . . . 0.01 106.576 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD21 ' O ' ' A' ' 21' ' ' ILE . 31.5 mt -57.47 -47.1 82.78 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -52.98 63.07 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.347 -0.845 . . . . 0.01 110.258 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.47 -39.18 81.48 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.259 -0.901 . . . . 0.01 108.998 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 34' ' ' LEU . 44.1 t80 -60.04 -50.03 75.33 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.805 -0.56 . . . . 0.0 110.13 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -58.71 -40.09 82.66 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.824 -1.173 . . . . 0.01 108.392 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.9 -37.58 81.91 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.452 -0.944 . . . . 0.01 108.452 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.427 ' CE2' ' OE2' ' A' ' 37' ' ' GLU . 70.0 t80 -60.0 -45.48 92.59 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.434 -0.791 . . . . 0.01 109.607 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 30' ' ' PHE . 97.7 mt -60.6 -41.43 94.74 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.042 -1.036 . . . . 0.0 108.485 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -59.96 -37.52 79.83 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.038 -1.097 . . . . 0.01 108.038 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -62.73 -25.3 68.12 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.525 ' CG ' ' NH2' ' A' ' 121' ' ' ARG . 99.1 mt-10 -107.36 9.87 29.77 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.888 -0.782 . . . . 0.01 108.888 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 51.72 39.43 25.34 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.821 -0.807 . . . . 0.01 108.821 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.2 p -114.91 35.97 4.07 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' O ' HG22 ' A' ' 43' ' ' ILE . 13.8 pt-20 -66.44 -27.59 67.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.834 -1.167 . . . . 0.0 109.315 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 11.3 pm0 -64.72 -29.03 70.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.678 -1.264 . . . . 0.0 108.88 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.98 -44.03 94.75 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.253 -0.905 . . . . 0.0 109.723 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 40' ' ' GLU . 5.6 tp -70.28 -39.94 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 120.596 -1.315 . . . . 0.0 109.069 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -65.33 -40.01 93.14 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -65.27 -38.66 91.0 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.402 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 70.4 t90 -59.96 -40.73 90.06 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.469 -0.769 . . . . 0.01 109.07 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.4 mt -68.13 -40.04 82.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.168 -0.957 . . . . 0.0 108.719 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.9 p -65.0 -44.89 87.77 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.219 -0.926 . . . . 0.0 109.074 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 8.0 p -71.21 -34.07 70.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.082 -1.012 . . . . 0.01 109.129 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 83.0 tt0 -60.02 -50.0 75.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.01 109.073 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.55 -37.39 81.09 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.318 -0.993 . . . . 0.01 108.318 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -60.03 -40.0 87.85 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.601 -0.889 . . . . 0.01 108.601 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 59.5 mttm -70.09 -20.02 63.23 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.3 -0.875 . . . . 0.01 109.853 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -85.59 -35.82 20.78 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.083 -1.011 . . . . 0.01 110.083 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.2 mt -66.88 120.89 14.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 C-N-CA 119.125 -1.03 . . . . 0.01 109.126 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -99.39 -0.09 41.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.584 -0.697 . . . . 0.01 109.64 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.4 m -95.79 110.87 53.74 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.362 -0.837 . . . . 0.01 108.837 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -68.38 -10.49 29.15 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 CA-C-N 120.324 1.152 . . . . 0.01 112.137 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 91.5 p -83.79 -23.72 31.34 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.29 -0.881 . . . . 0.01 109.574 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -92.21 -14.41 29.06 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.075 -1.016 . . . . 0.01 109.831 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.17 -40.09 93.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.06 -1.025 . . . . 0.01 109.606 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.433 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.2 -62.99 1.73 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.426 -0.796 . . . . 0.01 110.972 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.433 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 28.6 Cg_exo -37.71 -63.7 0.23 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 121.028 1.152 . . . . 0.01 113.459 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -71.63 -26.39 62.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.973 -1.079 . . . . 0.01 110.549 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.37 -53.87 52.26 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.848 -1.158 . . . . 0.01 109.052 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -59.97 -48.5 81.45 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.082 -1.011 . . . . 0.01 109.585 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.32 -47.98 83.71 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.224 -0.922 . . . . 0.01 109.076 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.7 mt -63.95 -50.65 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.01 108.673 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.613 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.0 t80 -60.28 -49.85 75.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.675 0.75 . . . . 0.01 109.529 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.6 m-20 -60.55 -39.97 89.89 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.764 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 79' ' ' LYS . 85.6 tt0 -78.6 -58.57 3.18 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 112.065 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -85.74 -31.35 22.46 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.928 -1.107 . . . . 0.0 113.981 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.613 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.9 mm -97.83 -10.57 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 120.447 -1.408 . . . . 0.01 112.412 -177.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 27.2 m -62.4 130.22 44.26 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.177 -1.577 . . . . 0.01 109.67 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 75' ' ' VAL . 4.2 m -60.75 -18.59 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 N-CA-C 108.733 -0.84 . . . . 0.01 108.733 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.68 0.62 45.01 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.457 -0.777 . . . . 0.01 109.154 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.44 141.27 9.3 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.345 -0.847 . . . . 0.01 109.511 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.3 p -69.53 -37.9 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.491 -0.929 . . . . 0.01 108.491 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 71' ' ' GLU . 44.8 pttt -109.88 69.25 0.69 Allowed 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.604 0.716 . . . . 0.01 109.672 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.98 142.19 54.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.274 -0.891 . . . . 0.01 109.488 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -100.87 149.22 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.337 -0.852 . . . . 0.0 108.891 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.401 ' ND2' HD23 ' A' ' 113' ' ' LEU . 7.3 p30 -73.97 106.32 5.61 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.332 -0.855 . . . . 0.0 109.79 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 81.8 mt -144.33 159.95 41.84 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.788 -0.819 . . . . 0.01 108.788 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 84' ' ' ASP . 9.3 p-10 -72.95 159.47 33.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.173 -0.954 . . . . 0.01 108.896 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.5 t -69.91 -19.48 63.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.284 -0.885 . . . . 0.01 109.689 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 40.6 t -81.03 -46.82 14.46 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.194 -0.941 . . . . 0.01 110.502 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 92.5 m -59.99 -40.75 90.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.968 -1.082 . . . . 0.01 109.384 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 83' ' ' LEU . 99.2 mtt180 -60.34 -49.96 75.52 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.065 -1.022 . . . . 0.01 108.824 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.31 -40.41 90.46 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.355 -0.841 . . . . 0.01 108.794 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 83.3 tt0 -60.05 -39.95 87.73 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.278 -0.889 . . . . 0.01 108.957 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 22.9 m -62.96 -40.09 96.63 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.418 -0.913 . . . . 0.01 108.845 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -60.27 -39.94 88.6 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.58 -0.7 . . . . 0.01 110.131 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.478 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.3 mtm180 -68.19 -35.83 78.64 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.901 -1.124 . . . . 0.01 109.834 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -64.6 -20.48 66.28 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.369 -0.832 . . . . 0.01 110.177 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 33.5 mmm -59.95 -36.7 77.62 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.105 -0.997 . . . . 0.01 108.684 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.58 -33.58 75.91 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.211 -1.033 . . . . 0.01 108.211 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -143.04 80.03 13.94 Favored Pre-proline 0 N--CA 1.494 1.727 0 N-CA-C 107.903 -1.147 . . . . 0.01 107.903 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -63.24 117.1 4.04 Favored 'Trans proline' 0 C--N 1.315 -1.232 0 C-N-CA 120.954 1.103 . . . . 0.01 112.322 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 76.0 p -111.77 171.36 7.54 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.447 -0.946 . . . . 0.01 108.447 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -69.51 -19.84 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.339 -0.851 . . . . 0.01 109.248 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.6 p -92.82 10.01 32.83 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.373 -0.829 . . . . 0.01 109.28 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.64 -63.79 1.18 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.01 110.878 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -91.29 -4.84 55.5 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.028 -1.045 . . . . 0.01 111.056 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.601 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 84.4 m-20 -59.87 -40.12 87.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.737 -1.227 . . . . 0.01 108.383 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.406 ' OE1' ' CD ' ' A' ' 90' ' ' GLU . 95.1 mt-10 -60.11 -39.95 87.97 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.575 -0.703 . . . . 0.01 109.735 179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.54 -45.68 82.47 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.012 -1.055 . . . . 0.0 108.971 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -59.96 -43.74 94.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.093 -1.004 . . . . 0.0 109.138 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -60.02 -42.08 93.57 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.3 -0.875 . . . . 0.01 108.755 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -65.76 -40.02 91.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.01 108.738 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.409 HD13 ' HA ' ' A' ' 110' ' ' ILE . 29.4 mm -66.46 -46.71 85.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 178.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.423 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.4 m-85 -60.08 -47.22 86.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.362 -0.836 . . . . 0.0 108.796 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -60.85 -39.88 90.8 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.188 -0.945 . . . . 0.01 110.398 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.401 HD23 ' ND2' ' A' ' 82' ' ' ASN . 56.5 tp -62.4 -59.53 4.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.024 -1.047 . . . . 0.0 109.942 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.554 ' O ' ' N ' ' A' ' 118' ' ' SER . 7.8 ptm -69.2 -40.43 78.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.644 -0.66 . . . . 0.0 110.647 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 84.9 tt0 -60.05 -46.53 89.24 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.894 -1.129 . . . . 0.01 109.763 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.31 -39.39 71.45 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.902 -1.124 . . . . 0.01 111.387 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -99.94 -41.22 7.29 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 120.772 -1.205 . . . . 0.0 112.292 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.554 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -61.1 -43.91 98.16 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.443 -1.411 . . . . 0.01 110.632 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.425 ' OH ' ' C ' ' A' ' 16' ' ' SER . 1.3 m-85 -54.4 -42.23 70.2 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.958 -1.089 . . . . 0.01 110.416 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -59.97 -49.11 78.96 Favored 'General case' 0 C--N 1.291 -1.938 0 C-N-CA 119.025 -1.07 . . . . 0.01 108.409 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' A' ' 125' ' ' SER . 21.1 mtm180 -73.11 -40.05 65.27 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.358 -0.839 . . . . 0.01 110.756 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.2 OUTLIER -58.09 -53.04 62.71 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.877 -1.14 . . . . 0.01 109.712 -178.463 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.44 -36.17 77.57 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.046 -1.034 . . . . 0.01 108.915 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -92.43 0.42 57.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.425 -0.797 . . . . 0.01 110.241 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 121' ' ' ARG . 47.8 t -70.04 151.4 45.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.842 -1.161 . . . . 0.01 110.704 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 -62.01 -40.36 95.42 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.726 -0.609 . . . . 0.01 110.092 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -60.86 -50.1 74.81 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.983 -1.073 . . . . 0.01 108.874 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.515 ' CD2' ' OG1' ' A' ' 132' ' ' THR . 66.2 t80 -60.03 -45.16 93.73 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.979 -0.748 . . . . 0.01 108.979 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.418 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 71.8 mt -59.98 -49.23 78.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.424 -0.798 . . . . 0.01 109.378 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -60.1 -48.02 83.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.196 -0.94 . . . . 3.77 109.216 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.36 -38.37 78.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.125 -1.065 . . . . 3.8700000000000001 108.125 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.64 HG22 HG21 ' A' ' 10' ' ' VAL . 6.2 p -118.12 87.42 2.72 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.712 -0.847 . . . . 4.6299999999999999 108.712 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.418 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 7.6 m120 . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.612 -1.305 . . . . 6.4800000000000004 108.155 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 108.768 -0.827 . . . . 18.699999999999999 108.768 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 61.0 p -73.99 157.82 35.47 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.197 -0.939 . . . . 15.970000000000001 109.113 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.98 -26.13 63.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.216 -0.927 . . . . 13.82 109.421 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.93 -39.12 83.53 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.068 -1.02 . . . . 15.06 110.68 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 95.6 mt-10 -70.12 -44.19 69.43 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.033 -1.042 . . . . 14.68 111.053 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.701 HG21 HG22 ' A' ' 132' ' ' THR . 25.8 m -61.83 -35.01 65.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.637 -1.29 . . . . 11.69 108.612 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -60.03 -40.05 88.03 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.493 -1.299 . . . . 10.51 107.493 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -65.95 -37.79 86.93 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.142 -1.058 . . . . 10.82 108.142 178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.521 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 38.9 m0 -60.02 -38.48 82.82 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.611 -0.681 . . . . 6.2599999999999998 109.912 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.9 -4.37 46.41 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.396 -1.44 . . . . 0.01 110.33 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -90.86 -20.33 22.4 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.982 -1.074 . . . . 0.01 110.545 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.439 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 57.2 p -172.84 146.46 1.58 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.844 -1.16 . . . . 0.01 111.017 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.785 HD12 ' CE1' ' A' ' 119' ' ' TYR . 11.0 tp -59.96 -40.68 89.88 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.587 0.708 . . . . 0.01 109.36 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 22' ' ' ASN . 97.1 mt-10 -57.81 -39.28 77.2 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.566 -0.709 . . . . 0.01 109.94 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -59.98 -49.91 75.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.052 . . . . 0.01 109.595 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.14 -40.51 94.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.184 -0.948 . . . . 0.01 109.066 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.04 -29.14 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.502 -0.749 . . . . 0.01 111.073 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 18' ' ' GLU . 99.6 m-20 -88.86 -1.36 58.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.748 -1.22 . . . . 0.01 111.4 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.45 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 42.7 t-80 -93.22 135.7 34.18 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.7 -1.25 . . . . 0.01 108.626 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.0 -40.0 87.71 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.01 110.137 -178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -82.74 -29.68 29.59 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.9 -1.125 . . . . 0.01 108.318 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.27 -48.32 86.74 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 107.783 -2.127 . . . . 0.01 107.783 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.7 mt -59.92 -48.48 81.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.315 -1.109 . . . . 0.01 108.872 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.61 93.71 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 120.886 -1.134 . . . . 0.01 108.413 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.51 77.99 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.528 -0.732 . . . . 0.01 109.281 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.694 ' CD2' HD11 ' A' ' 34' ' ' LEU . 28.9 t80 -66.63 -42.21 87.13 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.384 -0.823 . . . . 0.0 110.018 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HA ' HD12 ' A' ' 34' ' ' LEU . 68.5 mttm -59.99 -40.82 90.46 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.825 -1.172 . . . . 0.01 109.263 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 -45.1 75.57 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.707 -1.22 . . . . 0.01 107.707 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -60.02 -40.05 87.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.439 0.638 . . . . 0.01 109.626 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.694 HD11 ' CD2' ' A' ' 30' ' ' PHE . 28.6 mt -60.01 -33.18 71.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.482 -0.761 . . . . 0.0 108.964 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -59.15 -39.87 83.78 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.308 -0.997 . . . . 0.01 108.308 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -60.32 -33.89 73.03 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.479 -0.763 . . . . 0.0 109.571 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -99.93 4.73 45.15 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.297 -0.877 . . . . 0.01 109.808 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 54.49 26.66 7.4 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.455 -0.778 . . . . 0.01 109.157 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.451 ' HB2' HD22 ' A' ' 42' ' ' ASN . 2.5 p -97.64 31.4 2.6 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -67.51 -32.47 73.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.313 -0.867 . . . . 0.0 109.879 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.615 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.4 pm0 -62.51 -31.37 72.12 Favored 'General case' 0 C--N 1.296 -1.734 0 O-C-N 120.495 -1.378 . . . . 0.0 108.945 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.451 HD22 ' HB2' ' A' ' 39' ' ' SER . 78.9 m-20 -62.3 -41.94 98.93 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.293 -0.879 . . . . 0.0 111.091 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.2 tp -70.01 -40.03 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 120.338 -1.476 . . . . 0.0 108.696 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.62 -41.5 94.98 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -64.46 -40.03 94.93 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.529 ' CE3' ' OE1' ' A' ' 50' ' ' GLU . 53.4 t90 -60.04 -40.19 88.51 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.851 -0.796 . . . . 0.01 108.851 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.6 mt -65.87 -39.98 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.03 -1.044 . . . . 0.0 108.621 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -66.93 -40.02 87.49 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.541 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 3.0 p -65.23 -43.23 92.11 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.351 -0.843 . . . . 0.01 109.267 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.541 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 46.8 mt-10 -59.96 -47.19 86.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.893 -1.129 . . . . 0.01 108.423 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.43 -39.96 89.35 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.757 -1.201 . . . . 0.01 107.757 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -60.8 -40.73 93.76 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.495 -0.928 . . . . 0.01 108.495 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 61.6 mttp -69.94 -20.12 63.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.462 -0.774 . . . . 0.01 110.879 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -81.71 -38.61 25.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.779 -1.201 . . . . 0.01 109.484 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.4 mt -69.37 117.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.206 -0.934 . . . . 0.01 109.041 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -100.2 -0.0 39.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.01 109.701 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m -94.54 110.97 52.05 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.315 -0.866 . . . . 0.01 108.803 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.35 2.28 2.92 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 CA-C-N 120.247 1.124 . . . . 0.01 111.933 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -88.31 -28.7 20.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.372 -0.83 . . . . 0.01 109.257 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -91.71 -20.58 21.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.392 -0.817 . . . . 0.01 109.865 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.1 mt -60.66 -39.99 90.43 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -0.961 . . . . 0.01 109.426 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.463 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.78 -65.05 0.94 Allowed Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.01 110.959 -179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 12.1 Cg_exo -40.85 -61.63 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 120.83 1.02 . . . . 0.01 113.248 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -73.23 -30.07 63.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.006 -1.059 . . . . 0.01 110.758 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.04 74.41 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.73 -1.231 . . . . 0.01 109.099 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -63.51 -43.94 95.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.207 -0.933 . . . . 0.01 109.705 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -62.64 -50.04 72.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.027 -1.045 . . . . 0.01 109.104 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.81 -49.97 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 108.348 -0.982 . . . . 0.01 108.348 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.526 ' CE2' HG21 ' A' ' 73' ' ' ILE . 36.1 t80 -60.24 -43.81 95.77 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.479 0.657 . . . . 0.01 109.48 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -61.96 -40.01 94.09 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.259 -0.9 . . . . 0.01 110.026 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.559 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.9 mt-10 -86.66 -47.4 9.19 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.813 -1.179 . . . . 0.0 111.989 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -87.33 -44.39 11.43 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.799 -1.188 . . . . 0.0 113.857 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.526 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.6 mm -94.55 -11.32 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 120.505 -1.372 . . . . 0.01 112.699 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.44 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.9 t -59.93 133.56 56.21 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.272 -1.517 . . . . 0.01 110.101 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.7 m -59.92 -17.86 14.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 N-CA-C 107.646 -1.242 . . . . 0.01 107.646 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -98.65 1.83 46.64 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.251 -1.018 . . . . 0.01 108.251 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -43.65 132.89 4.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.601 -0.687 . . . . 0.01 110.596 -179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 37.1 p -70.38 -19.96 62.99 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.329 -0.989 . . . . 0.01 108.329 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -129.93 75.45 1.65 Allowed 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 74' ' ' SER . 48.6 mm-40 -60.09 143.87 51.04 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.232 -0.917 . . . . 0.01 110.94 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 m -112.58 143.0 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -73.16 113.21 9.96 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.062 -1.024 . . . . 0.0 109.352 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 92.9 mt -144.36 167.92 21.33 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.984 -0.747 . . . . 0.01 108.984 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 85' ' ' SER . 54.5 t0 -70.14 155.24 40.9 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.301 -0.875 . . . . 0.01 108.769 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.539 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 62.3 m -67.49 -29.65 69.13 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.01 109.376 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 32.9 m -84.59 -36.17 22.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.184 -0.947 . . . . 0.01 109.727 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -60.1 -45.43 92.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.99 -1.069 . . . . 0.01 109.392 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -60.05 -49.91 75.81 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.09 -1.006 . . . . 0.01 108.596 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -62.33 -40.63 97.0 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.803 -0.814 . . . . 0.01 108.803 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 86.1 tt0 -60.02 -42.42 94.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.596 -0.69 . . . . 0.01 109.184 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 74.3 m -61.81 -41.06 97.28 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.053 -1.092 . . . . 0.01 108.053 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.6 p -60.01 -47.59 85.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.343 -0.848 . . . . 0.01 109.326 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 87.1 mtm180 -63.34 -39.99 96.05 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.489 -0.93 . . . . 0.01 108.489 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -61.32 -37.89 84.88 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.652 -0.655 . . . . 0.01 109.612 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.46 -29.86 64.56 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.967 -1.083 . . . . 0.01 108.966 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.74 -27.18 68.73 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 107.021 -1.474 . . . . 0.01 107.021 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -134.44 78.93 55.8 Favored Pre-proline 0 N--CA 1.494 1.75 0 N-CA-C 106.92 -1.511 . . . . 0.01 106.92 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -57.59 119.22 6.33 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.155 1.237 . . . . 0.01 113.143 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 p -130.41 167.66 18.23 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.456 -0.942 . . . . 0.01 108.456 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.442 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.9 tp -73.72 -18.56 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.108 -0.995 . . . . 0.01 109.223 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.2 p -91.94 0.07 57.48 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.276 -0.89 . . . . 0.01 109.748 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.4 t -59.9 -56.73 18.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.01 110.697 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.8 -6.87 47.99 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.048 -1.033 . . . . 0.01 110.709 -178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -61.06 -40.02 92.08 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.687 -1.258 . . . . 0.01 108.594 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.429 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.2 tt0 -63.66 -37.77 88.6 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.927 -0.768 . . . . 0.01 108.927 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.91 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.241 -0.912 . . . . 0.0 109.629 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 40.9 tt0 -60.01 -40.62 89.88 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.865 -1.147 . . . . 0.0 108.675 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -59.98 -39.96 87.47 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.379 -0.825 . . . . 0.01 109.333 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -63.81 -39.91 95.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.989 . . . . 0.01 108.813 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.49 -42.02 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 O-C-N 121.176 -0.953 . . . . 0.0 109.101 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.625 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -61.67 -52.1 65.71 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.028 -1.045 . . . . 0.0 109.046 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -64.64 -41.46 96.12 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.017 -1.052 . . . . 0.01 109.752 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.1 tt -65.36 -55.45 18.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.989 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.48 ' O ' ' N ' ' A' ' 118' ' ' SER . 12.2 ptm -63.45 -39.21 93.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.117 -0.989 . . . . 0.0 109.759 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -60.13 -48.94 79.63 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 120.981 -1.074 . . . . 0.01 109.573 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -70.05 -39.99 75.37 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 120.386 -1.446 . . . . 0.01 110.364 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -83.62 -45.16 13.78 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.09 -1.006 . . . . 0.0 111.847 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.48 ' N ' ' O ' ' A' ' 114' ' ' MET . 24.6 p -83.93 -65.2 1.04 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.775 -1.203 . . . . 0.01 112.74 -177.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.785 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -44.84 -48.19 11.05 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.898 -1.126 . . . . 0.01 111.008 -177.467 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -59.92 -47.33 86.24 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.679 -1.263 . . . . 0.01 108.107 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 121' ' ' ARG . 5.2 mtt-85 -69.91 -40.0 75.86 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.059 -1.025 . . . . 0.01 108.802 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.434 ' O ' ' OG ' ' A' ' 125' ' ' SER . 3.8 t80 -54.12 -57.11 12.32 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.415 -0.803 . . . . 0.01 110.386 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.7 mt -59.97 -40.04 87.72 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.422 -0.799 . . . . 0.01 109.684 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt -84.3 -10.01 58.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.01 110.222 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 78.6 p -75.21 160.31 30.55 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.817 -1.177 . . . . 0.01 109.734 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.514 ' HG2' HH11 ' A' ' 126' ' ' ARG . 21.8 mtt-85 -66.72 -35.54 80.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.483 -0.761 . . . . 0.01 110.421 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -53.44 -55.06 28.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.018 -1.051 . . . . 0.01 109.447 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.713 ' CZ ' HG21 ' A' ' 132' ' ' THR . 72.7 t80 -60.88 -47.72 85.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.079 -1.013 . . . . 0.01 110.222 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 89.3 mt -59.97 -50.68 72.78 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.327 -0.858 . . . . 0.01 111.003 -178.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -60.86 -44.85 96.47 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.809 -1.182 . . . . 3.77 110.098 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.1 -27.34 64.51 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.866 -1.161 . . . . 3.8700000000000001 107.866 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.713 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.4 p -109.92 78.3 1.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.561 -0.903 . . . . 4.6299999999999999 108.561 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 C--N 1.299 -1.617 0 N-CA-C 108.566 -0.902 . . . . 6.4800000000000004 108.566 -179.646 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 121.199 0.523 . . . . 18.699999999999999 109.739 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 93.3 p -78.44 150.25 33.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.398 -0.814 . . . . 15.970000000000001 109.135 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.426 HE22 ' HA ' ' A' ' 132' ' ' THR . 13.1 mm100 -68.45 -32.59 72.71 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.227 -0.921 . . . . 13.82 109.71 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.83 -37.44 86.79 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 120.585 -1.322 . . . . 15.06 110.143 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.672 ' HG2' ' HE2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -72.94 -40.64 65.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.219 -0.926 . . . . 14.68 111.846 -178.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.649 HG21 HG22 ' A' ' 132' ' ' THR . 1.9 m -60.05 -38.73 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.128 -1.608 . . . . 11.69 109.195 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -59.02 -29.94 67.64 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.8 -0.815 . . . . 10.51 108.8 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -60.0 -34.11 72.89 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.801 -1.185 . . . . 10.82 107.801 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 36.5 m0 -59.95 -36.38 76.97 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.436 -0.79 . . . . 6.2599999999999998 108.963 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.89 -4.74 53.59 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.574 -1.329 . . . . 0.01 109.145 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -96.57 -30.79 13.09 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.285 -0.884 . . . . 0.01 111.029 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 56.4 p -172.12 144.62 1.67 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.639 -1.288 . . . . 0.01 110.977 -179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.9 HD21 ' SD ' ' A' ' 114' ' ' MET . 32.0 tp -59.56 -38.97 82.54 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.882 -0.511 . . . . 0.01 109.696 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -52.7 -39.95 62.49 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.231 -0.918 . . . . 0.01 109.792 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.86 -42.71 99.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.255 -0.903 . . . . 0.01 110.755 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.9 tp -60.11 -41.13 91.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.074 -1.016 . . . . 0.01 109.93 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.483 ' O ' HD21 ' A' ' 27' ' ' LEU . 42.9 pt -87.6 -21.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.824 -1.172 . . . . 0.01 110.108 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -90.44 -4.52 56.94 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.714 -1.241 . . . . 0.01 110.777 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 9' ' ' GLU . 43.6 t-80 -94.59 142.36 27.54 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.902 -1.124 . . . . 0.01 109.47 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -39.89 88.35 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.51 -0.744 . . . . 0.01 109.702 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.04 -34.13 26.3 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.01 108.415 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.46 -44.74 96.44 Favored Glycine 0 N--CA 1.482 1.713 0 N-CA-C 107.62 -2.192 . . . . 0.01 107.62 178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.483 HD21 ' O ' ' A' ' 21' ' ' ILE . 41.0 mt -59.97 -50.06 75.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.282 -1.128 . . . . 0.01 108.962 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.62 -47.0 88.17 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.032 -1.042 . . . . 0.01 109.275 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.34 -43.16 74.23 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.41 -0.806 . . . . 0.01 108.96 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.852 ' CE2' HD11 ' A' ' 34' ' ' LEU . 54.6 t80 -60.03 -46.35 89.8 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.02 -39.45 85.86 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.081 -1.081 . . . . 0.01 108.081 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.4 94.73 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.0 -46.58 88.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.314 -0.995 . . . . 0.01 108.314 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.852 HD11 ' CE2' ' A' ' 30' ' ' PHE . 94.8 mt -61.34 -39.46 90.65 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.97 -39.9 87.24 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.524 -0.917 . . . . 0.01 108.524 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 m -60.1 -37.75 80.91 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -99.72 5.26 45.72 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.562 -0.903 . . . . 0.01 108.562 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.525 ' N ' ' O ' ' A' ' 34' ' ' LEU . 92.2 m-85 52.9 38.62 27.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.613 -0.679 . . . . 0.01 109.737 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -105.81 38.85 1.9 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.1 pm0 -61.46 -17.99 56.96 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.244 -0.91 . . . . 0.0 109.316 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.412 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.4 pt-20 -62.18 -35.99 80.5 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.268 -0.895 . . . . 0.0 109.138 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -47.79 84.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.381 -0.824 . . . . 0.0 110.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.3 tp -70.03 -40.07 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.719 -1.238 . . . . 0.0 109.322 -179.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.96 -41.83 99.64 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -64.98 -40.04 94.38 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 89.8 t90 -59.92 -40.27 88.31 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.458 -0.776 . . . . 0.01 109.493 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.5 mt -65.01 -40.0 87.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 O-C-N 121.339 -0.851 . . . . 0.0 108.777 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 63.9 p -69.53 -39.95 77.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.367 -0.833 . . . . 0.0 109.666 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.545 ' SG ' ' N ' ' A' ' 50' ' ' GLU . 11.2 p -64.2 -42.77 96.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.052 -1.03 . . . . 0.01 109.836 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.545 ' N ' ' SG ' ' A' ' 49' ' ' CYS . 72.9 mm-40 -60.04 -42.55 94.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.165 -0.96 . . . . 0.01 109.328 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.03 -40.04 87.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.353 -0.98 . . . . 0.01 108.353 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.408 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 34.2 t80 -61.67 -40.07 93.65 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.373 0.606 . . . . 0.01 109.475 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.519 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 54.6 mttp -70.05 -16.78 63.2 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.349 -0.845 . . . . 0.01 110.73 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -84.33 -40.06 18.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.88 -1.137 . . . . 0.01 108.904 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.442 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -69.51 114.57 6.85 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.213 -0.929 . . . . 0.01 108.638 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -98.06 0.17 45.68 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.259 -0.901 . . . . 0.01 109.86 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.9 m -93.34 112.54 56.88 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.01 109.245 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -67.91 4.24 1.56 Allowed 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 120.376 1.17 . . . . 0.01 111.757 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.3 t -88.23 -32.02 18.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.319 -0.863 . . . . 0.01 109.926 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -94.26 -14.03 25.92 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.1 -1.0 . . . . 0.01 110.646 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.408 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.5 mt -60.36 -39.95 89.01 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.806 -1.184 . . . . 0.01 110.276 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.437 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -49.95 -64.24 1.35 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.059 . . . . 0.01 111.272 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.437 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 26.5 Cg_exo -37.16 -62.69 0.26 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.179 1.253 . . . . 0.01 113.907 -179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.442 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 15.3 ptpt -71.43 -29.01 64.39 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.907 -1.121 . . . . 0.01 110.556 -178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.54 79.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.801 -1.187 . . . . 0.01 108.406 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -60.06 -44.31 94.82 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.93 -46.98 79.38 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.336 -0.853 . . . . 0.01 109.377 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -69.91 -45.22 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.291 -0.881 . . . . 0.01 109.145 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 73' ' ' ILE . 63.8 t80 -60.97 -49.99 75.19 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.348 -0.845 . . . . 0.01 109.885 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -67.67 -38.01 83.17 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.304 -0.872 . . . . 0.01 110.156 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.19 -27.55 59.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.331 -0.855 . . . . 0.0 112.394 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.62 -19.98 2.95 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 120.48 -1.388 . . . . 0.0 113.163 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 69' ' ' TYR . 51.8 mm -104.82 -28.42 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.606 -1.309 . . . . 0.01 111.492 -178.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.446 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 2.5 m -59.88 129.96 44.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.558 -1.338 . . . . 0.01 109.48 -179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.2 m -57.52 -14.71 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.352 -0.843 . . . . 0.01 109.016 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -100.52 -5.3 27.13 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.268 -0.895 . . . . 0.01 109.65 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.467 ' HB3' ' OE2' ' A' ' 80' ' ' GLU . . . -51.39 144.65 9.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.16 -0.963 . . . . 0.01 109.588 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 82.4 p -71.74 -19.39 62.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.01 109.63 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -137.2 85.45 2.13 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.424 -0.797 . . . . 0.01 109.526 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.467 ' OE2' ' HB3' ' A' ' 77' ' ' ALA . 34.3 mm-40 -77.79 158.36 29.59 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.27 -0.894 . . . . 0.01 109.72 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.5 148.29 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.497 ' H ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -73.88 107.43 6.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.023 -1.048 . . . . 0.0 109.645 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 98.7 mt -144.39 162.2 37.09 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.65 -0.87 . . . . 0.01 108.65 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.523 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 13.3 p-10 -71.62 162.58 29.22 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.298 -0.876 . . . . 0.01 109.187 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 68.2 m -69.77 -16.23 63.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.264 -0.898 . . . . 0.01 110.004 -179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 9.8 t -82.66 -48.44 10.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.068 -1.02 . . . . 0.01 110.039 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.451 ' HG1' ' HE3' ' A' ' 109' ' ' LYS . 94.5 m -60.08 -42.16 93.98 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.169 -0.957 . . . . 0.01 110.463 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -60.17 -46.78 88.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.997 -1.065 . . . . 0.01 109.503 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.11 -39.72 87.19 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.419 -0.801 . . . . 0.01 109.536 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.0 -40.59 89.72 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.09 -1.006 . . . . 0.01 109.523 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.401 HG21 ' CE2' ' A' ' 103' ' ' PHE . 6.5 m -65.6 -41.02 93.27 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 118.855 -1.138 . . . . 0.01 108.395 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.3 p -59.99 -38.97 84.13 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.789 0.804 . . . . 0.01 108.832 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.462 ' HG2' HH11 ' A' ' 93' ' ' ARG . 35.4 mtt-85 -69.22 -37.45 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.166 -0.959 . . . . 0.01 109.548 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' PRO . 93.6 m-20 -64.33 -20.39 66.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.387 -0.821 . . . . 0.01 110.623 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.8 mmm -60.06 -37.95 81.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.882 -1.136 . . . . 0.01 108.763 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.3 mp -67.53 -31.47 71.59 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.156 -1.053 . . . . 0.01 108.156 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -144.14 76.26 15.09 Favored Pre-proline 0 N--CA 1.492 1.653 0 N-CA-C 108.284 -1.006 . . . . 0.01 108.284 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.464 ' N ' ' O ' ' A' ' 94' ' ' ASN . 2.9 Cg_exo -63.82 115.57 3.17 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.295 1.33 . . . . 0.01 112.322 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.0 p -109.14 171.83 7.2 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.64 -0.662 . . . . 0.01 109.345 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.9 tp -70.92 -20.61 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.418 -0.801 . . . . 0.01 109.233 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.7 p -95.47 8.73 42.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.342 -0.849 . . . . 0.01 109.197 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.63 -60.99 2.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.522 -0.736 . . . . 0.01 110.711 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.401 ' CE2' HG21 ' A' ' 91' ' ' THR . 82.0 m-85 -91.69 -2.99 56.8 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.057 -1.027 . . . . 0.01 110.824 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.406 ' HA ' ' HZ1' ' A' ' 53' ' ' LYS . 73.1 m-20 -61.59 -39.94 92.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.712 -1.242 . . . . 0.01 108.712 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -63.12 -37.04 85.66 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.709 -0.848 . . . . 0.01 108.709 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.46 -42.05 79.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.093 -1.004 . . . . 0.0 109.265 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.519 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 51.8 tt0 -60.1 -39.89 87.74 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -59.88 -40.09 87.52 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.647 -0.871 . . . . 0.01 108.647 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HE3' ' HG1' ' A' ' 87' ' ' THR . 52.0 mmtt -64.36 -39.37 93.74 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.371 -0.831 . . . . 0.01 109.071 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.4 mm -67.39 -42.08 86.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 119.094 -1.042 . . . . 0.0 108.459 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.873 ' CD2' HD23 ' A' ' 17' ' ' LEU . 2.1 m-85 -58.32 -42.76 87.48 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.552 ' ND2' ' HZ1' ' A' ' 116' ' ' LYS . 20.3 m120 -62.49 -39.97 95.19 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.382 -0.824 . . . . 0.01 109.581 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 39.4 tp -61.83 -58.51 7.68 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.296 -0.878 . . . . 0.0 110.537 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.9 ' SD ' HD21 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.63 -40.01 84.63 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.983 -1.073 . . . . 0.0 109.813 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB2' HD22 ' A' ' 17' ' ' LEU . 81.9 tt0 -66.22 -40.25 90.18 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.93 -1.106 . . . . 0.01 110.91 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.552 ' HZ1' ' ND2' ' A' ' 112' ' ' ASN . 59.8 mttp -84.08 -22.5 31.15 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.313 -1.492 . . . . 0.01 111.131 -178.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -112.3 -64.04 1.35 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.218 -0.926 . . . . 0.0 111.753 -178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 28.3 p -60.78 -40.98 94.64 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.143 -0.973 . . . . 0.01 111.919 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.95 -52.44 65.38 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.661 -1.274 . . . . 0.01 110.408 -178.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.422 HH11 ' HG3' ' A' ' 120' ' ' ARG . 25.2 mmm-85 -60.18 -39.94 88.23 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.8 -1.16 . . . . 0.01 108.14 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 23.1 mmm-85 -70.01 -40.52 75.2 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.212 -0.995 . . . . 0.01 109.0 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.54 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 1.4 m-85 -60.42 -49.92 75.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.98 -1.075 . . . . 0.01 109.214 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.91 -23.04 63.19 Favored 'General case' 0 C--N 1.295 -1.803 0 O-C-N 120.371 -1.456 . . . . 0.01 108.344 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -116.47 21.41 13.54 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.53 -0.731 . . . . 0.01 110.412 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 72.8 p -92.8 157.06 16.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.8 -1.187 . . . . 0.01 109.889 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.415 ' NH1' ' HG2' ' A' ' 126' ' ' ARG . 39.8 ttt-85 -63.8 -46.75 83.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.401 -0.812 . . . . 0.01 110.012 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -59.9 -43.95 94.53 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.195 -0.94 . . . . 0.01 109.326 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.735 ' CE1' HG21 ' A' ' 132' ' ' THR . 71.5 t80 -60.06 -46.6 89.02 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.425 -0.797 . . . . 0.01 109.996 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.11 -49.02 79.28 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.67 -1.269 . . . . 0.01 109.118 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.48 -48.45 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.056 -1.027 . . . . 3.77 109.767 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.7 mt -69.95 -34.22 73.13 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.01 -1.108 . . . . 3.8700000000000001 108.01 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.735 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p -117.92 91.88 3.69 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.911 -1.144 . . . . 4.6299999999999999 107.911 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 . . . . . 0 C--N 1.293 -1.853 0 O-C-N 121.05 -1.031 . . . . 6.4800000000000004 108.708 -179.23 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 109.475 -0.565 . . . . 18.699999999999999 109.475 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' OE1' ' A' ' 9' ' ' GLU . 87.0 p -77.63 160.69 28.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 15.970000000000001 110.042 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -62.75 -34.73 77.81 Favored 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 121.498 0.666 . . . . 13.82 111.275 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -62.49 -39.93 95.09 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 120.951 -1.093 . . . . 15.06 111.628 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' O ' ' CD1' ' A' ' 13' ' ' TRP . 3.4 mp0 -69.88 -43.54 71.62 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.34 -1.475 . . . . 14.68 110.721 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.8 m -59.88 -40.91 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 120.414 -1.429 . . . . 11.69 108.204 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -60.36 -40.47 90.89 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 120.953 -1.092 . . . . 10.51 108.272 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -68.38 -30.07 68.92 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.217 -0.927 . . . . 10.82 108.956 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.528 ' CD1' ' O ' ' A' ' 9' ' ' GLU . 41.8 m0 -60.15 -34.34 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.169 -1.048 . . . . 6.2599999999999998 108.169 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.69 -8.87 59.12 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.619 -1.301 . . . . 0.01 109.035 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -93.44 -26.48 17.19 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.297 -0.877 . . . . 0.01 110.945 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.501 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 31.7 p -174.28 144.63 0.95 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.816 -1.178 . . . . 0.01 111.337 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 111' ' ' PHE . 58.3 tp -60.01 -40.25 88.62 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.596 -0.69 . . . . 0.01 110.96 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 22' ' ' ASN . 98.8 mt-10 -55.42 -38.05 68.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.107 . . . . 0.01 110.508 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.501 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.0 m-20 -60.29 -45.84 91.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.935 -1.103 . . . . 0.01 109.101 -179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.47 -41.98 95.27 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.31 -0.868 . . . . 0.01 108.795 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.5 mt -79.23 -19.77 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.538 -0.726 . . . . 0.01 111.113 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 18' ' ' GLU . 6.0 m120 -90.7 -8.57 49.51 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.741 -1.224 . . . . 0.01 112.22 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -88.99 127.4 35.67 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.432 -1.418 . . . . 0.01 109.22 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -57.44 -39.77 76.99 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.602 -0.686 . . . . 0.01 109.64 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -81.67 -34.18 30.87 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.259 -0.901 . . . . 0.01 108.809 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.15 -39.85 96.42 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 107.185 -2.366 . . . . 0.01 107.185 178.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.94 -44.8 94.16 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.628 -1.249 . . . . 0.01 107.628 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.132 -1.062 . . . . 0.01 108.132 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -40.37 79.22 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.294 -1.002 . . . . 0.01 108.294 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.533 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 40.1 t80 -62.16 -47.58 83.91 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -58.28 -40.06 80.93 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.844 -1.16 . . . . 0.01 108.92 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.34 -44.2 83.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.824 -1.176 . . . . 0.01 107.824 178.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.484 ' CG ' ' CE2' ' A' ' 122' ' ' PHE . 65.9 t80 -59.95 -39.77 86.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.748 -0.595 . . . . 0.01 110.634 179.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.2 mt -59.93 -39.83 86.85 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.994 -1.066 . . . . 0.0 108.625 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -58.59 -37.71 76.37 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 m -60.07 -39.73 87.07 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.351 -0.843 . . . . 0.0 109.115 179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -102.68 7.41 39.81 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.445 -0.785 . . . . 0.01 109.377 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 34' ' ' LEU . 75.9 m-85 51.9 37.97 22.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.287 -0.883 . . . . 0.01 110.036 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 34' ' ' LEU . 3.0 m -108.54 31.93 5.23 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.85 -27.99 69.54 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.42 -0.8 . . . . 0.0 110.092 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.587 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 2.0 pm0 -62.35 -28.5 69.8 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 120.588 -1.32 . . . . 0.0 109.098 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.421 HD22 ' HG2' ' A' ' 41' ' ' GLU . 1.9 m-80 -59.93 -46.4 89.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.128 -0.982 . . . . 0.0 110.902 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.9 tp -70.05 -42.02 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.515 -1.366 . . . . 0.0 109.273 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -61.11 -41.12 96.11 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.94 -44.7 95.34 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 177.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 65.6 t90 -60.27 -47.15 87.23 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 121.33 0.586 . . . . 0.01 109.533 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.7 mt -61.04 -40.13 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.6 p -68.46 -39.76 81.32 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.572 ' SG ' ' NZ ' ' A' ' 53' ' ' LYS . 9.3 t -64.84 -43.13 94.04 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.481 -0.762 . . . . 0.01 109.581 179.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -59.91 -43.5 94.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.04 -1.038 . . . . 0.01 109.083 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.44 -39.64 88.24 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.052 -1.092 . . . . 0.01 108.052 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.457 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 28.7 t80 -59.85 -39.31 84.78 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.985 -0.746 . . . . 0.01 108.985 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 59.1 mttp -69.75 -18.92 63.54 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.421 -0.8 . . . . 0.01 109.886 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -82.64 -42.17 18.53 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 120.927 -1.108 . . . . 0.01 109.505 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 94.8 mt -68.68 119.04 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.047 -1.033 . . . . 0.01 108.672 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -100.91 1.24 39.69 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.324 -0.86 . . . . 0.01 109.897 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m -95.2 111.07 53.62 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.295 -0.878 . . . . 0.01 109.375 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -66.38 0.82 3.01 Favored 'Trans proline' 0 N--CA 1.49 1.282 0 CA-C-N 120.219 1.114 . . . . 0.01 112.002 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.0 p -87.15 -30.45 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.01 109.763 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -93.09 -16.33 25.07 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.037 -1.039 . . . . 0.01 110.275 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.457 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 85.9 mt -62.01 -38.93 90.49 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.931 -1.106 . . . . 0.01 109.368 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -49.63 -64.63 1.12 Allowed Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.031 -1.043 . . . . 0.01 110.931 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 13.0 Cg_exo -40.79 -58.93 0.87 Allowed 'Trans proline' 0 N--CA 1.488 1.195 0 C-N-CA 120.898 1.065 . . . . 0.01 112.816 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HZ3' ' HA ' ' A' ' 52' ' ' TYR . 15.7 ptmt -71.26 -32.36 68.64 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.044 -1.035 . . . . 0.01 110.198 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.34 86.22 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.646 -1.284 . . . . 0.01 108.653 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -61.73 -47.58 84.61 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.516 -0.74 . . . . 0.01 110.098 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.93 -40.39 91.36 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.097 -1.002 . . . . 0.01 109.452 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 90.3 mt -70.65 -49.0 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.957 . . . . 0.01 109.143 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.634 ' CE2' HG21 ' A' ' 73' ' ' ILE . 47.3 t80 -59.99 -49.77 76.37 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.325 -0.86 . . . . 0.01 109.425 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.67 -40.03 93.49 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.524 -0.735 . . . . 0.01 110.085 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -77.43 -55.83 5.05 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.969 -1.082 . . . . 0.0 111.393 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.12 -36.13 17.06 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.5 mm -94.84 -11.62 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.483 0 O-C-N 120.4 -1.438 . . . . 0.01 112.634 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 130.02 44.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.297 -1.502 . . . . 0.01 109.84 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.455 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 29.3 m -61.03 -14.89 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.246 -0.909 . . . . 0.01 108.991 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -99.99 -0.03 40.1 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.288 -0.882 . . . . 0.01 108.943 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.77 138.93 13.9 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.203 -0.935 . . . . 0.01 109.692 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 39.8 p -70.27 -19.89 63.08 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.396 -0.815 . . . . 0.01 108.951 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 pttt -132.25 71.4 1.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 97.2 mt-10 -59.89 141.85 54.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.452 -0.78 . . . . 0.01 109.825 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.568 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.2 m -92.14 148.82 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.91 102.07 3.35 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.704 -1.247 . . . . 0.0 109.973 -179.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -145.32 156.35 43.75 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 108.725 -0.843 . . . . 0.01 108.725 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -73.39 160.3 31.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.239 -0.913 . . . . 0.01 109.884 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 84.0 p -69.32 -17.14 63.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.454 -0.779 . . . . 0.01 109.56 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 76.4 m -80.3 -46.88 15.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.163 -0.961 . . . . 0.01 109.313 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 90.6 m -60.09 -40.17 88.66 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.036 -1.04 . . . . 0.01 108.81 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.568 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 60.0 mtt-85 -59.39 -49.39 77.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.039 -1.038 . . . . 0.01 108.549 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -60.08 -39.97 87.91 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.808 -0.812 . . . . 0.01 108.808 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -60.17 -40.29 89.43 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.356 -0.84 . . . . 0.01 109.1 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.2 m -62.93 -42.17 99.71 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.91 -1.119 . . . . 0.01 108.226 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.6 p -59.92 -40.51 89.12 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.231 -0.918 . . . . 0.01 108.863 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -67.37 -40.0 85.72 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.01 109.098 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -63.91 -37.91 89.15 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.282 -0.887 . . . . 0.01 108.657 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.586 ' SD ' ' CG ' ' A' ' 69' ' ' TYR . 88.6 mtp -59.88 -31.65 69.98 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.45 -0.781 . . . . 0.01 109.996 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.75 -28.84 69.85 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 107.661 -1.236 . . . . 0.01 107.661 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.443 ' OE1' ' CG2' ' A' ' 99' ' ' THR . 0.6 OUTLIER -143.56 79.89 13.4 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 106.371 -1.715 . . . . 0.01 106.371 179.084 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -54.24 118.23 4.79 Favored 'Trans proline' 0 N--CA 1.489 1.214 0 C-N-CA 121.209 1.273 . . . . 0.01 113.914 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.443 ' CG2' ' OE1' ' A' ' 97' ' ' GLU . 65.5 p -116.66 169.78 9.09 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.994 -1.113 . . . . 0.01 107.994 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -72.32 -19.87 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.01 109.625 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.6 p -96.44 15.66 20.77 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.208 -0.933 . . . . 0.01 109.268 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.1 t -60.42 -56.37 22.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.63 -0.669 . . . . 0.01 110.685 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -96.96 -1.44 45.65 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.094 -1.004 . . . . 0.01 110.75 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -62.97 -39.44 94.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.75 -1.219 . . . . 0.01 109.417 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -60.46 -40.01 89.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.286 -0.884 . . . . 0.01 109.258 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.76 -39.89 84.1 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.341 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.571 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 24.9 tt0 -59.91 -41.32 91.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.997 -1.064 . . . . 0.0 108.379 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -59.93 -43.5 94.9 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.458 -0.941 . . . . 0.01 108.458 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -63.65 -40.17 96.18 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.465 -0.772 . . . . 0.01 109.087 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.1 mm -69.38 -44.18 80.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.056 -1.028 . . . . 0.0 108.584 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.503 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -60.13 -52.38 65.58 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.079 -1.013 . . . . 0.0 108.596 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -63.98 -39.92 95.23 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.171 -0.955 . . . . 0.01 110.021 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.06 -59.26 4.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.026 -1.046 . . . . 0.0 110.264 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.46 ' SD ' HD21 ' A' ' 17' ' ' LEU . 8.8 ptm -61.2 -38.44 86.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.176 -0.952 . . . . 0.0 108.993 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -61.94 -39.96 93.87 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.354 -0.842 . . . . 0.01 109.554 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -83.86 -18.6 37.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.543 -1.348 . . . . 0.01 111.223 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -117.78 -62.35 1.57 Allowed 'General case' 0 N--CA 1.508 2.473 0 O-C-N 120.94 -1.1 . . . . 0.0 111.986 -178.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.3 p -59.95 -41.38 91.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.703 -1.248 . . . . 0.01 111.13 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.513 ' OH ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -58.54 -46.37 86.96 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.223 -0.923 . . . . 0.01 110.563 -178.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.93 -41.1 99.38 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.049 -1.032 . . . . 0.01 108.98 -178.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -70.36 -37.89 74.67 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 178.445 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.484 ' CE2' ' CG ' ' A' ' 33' ' ' PHE . 0.2 OUTLIER -60.17 -45.9 91.53 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.105 -0.997 . . . . 0.01 108.885 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.94 -37.49 79.67 Favored 'General case' 0 C--N 1.294 -1.808 0 C-N-CA 119.51 -0.876 . . . . 0.01 108.656 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -93.38 -1.52 55.76 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.513 -0.742 . . . . 0.01 109.999 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 121' ' ' ARG . 79.4 p -71.01 157.73 37.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.932 -1.105 . . . . 0.01 110.028 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.433 HH11 ' HG3' ' A' ' 126' ' ' ARG . 31.3 mtm-85 -64.18 -39.92 95.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.805 -0.56 . . . . 0.01 110.577 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -59.61 -49.14 78.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.137 -0.977 . . . . 0.01 109.395 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.486 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.9 t80 -65.74 -50.82 63.42 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.187 -0.946 . . . . 0.01 109.427 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.88 -45.25 95.32 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.355 -0.841 . . . . 0.01 109.149 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.98 -49.45 77.64 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.157 -0.964 . . . . 3.77 108.771 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 40.5 mt -70.16 -39.42 75.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 3.8700000000000001 109.936 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.486 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 36.0 p -104.06 56.1 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.463 -0.773 . . . . 4.6299999999999999 110.946 -178.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 . . . . . 0 N--CA 1.495 1.79 0 O-C-N 120.713 -1.242 . . . . 6.4800000000000004 107.952 178.911 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.496 1.838 0 N-CA-C 109.038 -0.727 . . . . 18.699999999999999 109.038 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.2 p -73.96 160.11 31.82 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.296 -0.878 . . . . 15.970000000000001 109.923 -179.687 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.455 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 23.4 mp0 -69.16 -25.68 64.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.42 -0.8 . . . . 13.82 109.075 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.36 -40.08 77.71 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 120.932 -1.105 . . . . 15.06 109.824 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.728 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 95.0 mt-10 -69.96 -43.29 71.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.18 -0.95 . . . . 14.68 111.105 -178.205 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.684 HG21 HG22 ' A' ' 132' ' ' THR . 20.3 m -65.57 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 120.712 -1.243 . . . . 11.69 109.212 179.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 53.8 mtpt -58.74 -39.99 82.5 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 120.688 -1.258 . . . . 10.51 108.162 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -63.53 -36.8 84.98 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.325 -0.991 . . . . 10.82 108.325 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.564 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.9 m0 -57.74 -28.21 63.7 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 108.386 -0.968 . . . . 6.2599999999999998 108.386 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.4 -7.64 59.23 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.904 -1.122 . . . . 0.01 109.166 179.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -92.58 -31.42 15.19 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.287 -0.883 . . . . 0.01 111.193 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.473 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 97.8 p -170.22 146.05 2.88 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.592 -1.318 . . . . 0.01 110.851 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.6 tp -59.78 -39.01 83.47 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.804 -0.56 . . . . 0.01 110.134 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -49.04 -50.05 38.3 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.335 -0.853 . . . . 0.01 110.196 -178.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -60.24 -46.83 88.41 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.003 -1.06 . . . . 0.01 110.776 -179.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.3 tp -59.91 -49.86 76.05 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.953 -1.092 . . . . 0.01 110.168 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.654 ' O ' HD21 ' A' ' 27' ' ' LEU . 10.9 tt -79.49 -19.66 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.015 -1.053 . . . . 0.01 110.538 -178.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -92.59 -2.18 56.34 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.31 -1.494 . . . . 0.01 110.19 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.728 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 58.3 t-80 -91.7 140.33 29.82 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.962 -1.087 . . . . 0.01 108.728 179.865 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 tp10 -59.98 -40.08 87.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.01 110.177 -178.392 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t -84.88 -32.67 23.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.77 -1.206 . . . . 0.01 108.519 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.99 -41.51 99.46 Favored Glycine 0 N--CA 1.483 1.786 0 N-CA-C 107.417 -2.273 . . . . 0.01 107.417 178.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.654 HD21 ' O ' ' A' ' 21' ' ' ILE . 34.6 mt -59.81 -55.16 37.69 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.389 -0.967 . . . . 0.01 108.389 178.621 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.92 -44.92 94.02 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.184 -0.948 . . . . 0.01 109.638 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.49 -41.06 76.62 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.33 -0.856 . . . . 0.01 109.551 179.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.687 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 56.1 t80 -68.84 -41.18 78.86 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.179 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -59.77 -39.1 83.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.001 -1.062 . . . . 0.01 108.299 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.36 -47.6 85.1 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.151 -1.055 . . . . 0.01 108.151 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.14 -39.05 88.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.637 -0.664 . . . . 0.01 111.441 179.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.687 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 92.3 mt -59.89 -39.84 86.72 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.688 -1.258 . . . . 0.0 109.312 -178.282 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -60.04 -34.0 72.8 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.15 -0.969 . . . . 0.01 109.196 179.334 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.8 m -59.99 -37.22 79.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.09 -1.006 . . . . 0.0 109.059 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.84 10.18 41.76 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.241 -0.912 . . . . 0.01 108.622 179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 55.94 35.42 25.46 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.436 0.636 . . . . 0.01 109.875 179.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.564 ' CB ' HD22 ' A' ' 42' ' ' ASN . 1.9 t -103.34 34.31 2.98 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.405 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 43' ' ' ILE . 16.8 pt-20 -69.16 -34.69 75.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.004 -1.06 . . . . 0.0 109.987 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' A' ' 41' ' ' GLU . 1.3 pm0 -62.75 -30.52 71.5 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.677 -1.265 . . . . 0.0 108.66 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.632 HD21 ' ND2' ' A' ' 82' ' ' ASN . 81.7 m-20 -60.82 -44.67 96.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.28 -0.887 . . . . 0.0 110.219 179.785 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 40' ' ' GLU . 4.4 tp -70.16 -39.96 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 120.749 -1.219 . . . . 0.0 109.094 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -62.02 -40.1 94.54 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 178.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.97 -39.94 90.82 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.122 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.531 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 24.5 t90 -60.14 -45.2 93.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.624 -0.672 . . . . 0.01 109.206 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.69 -41.59 93.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.0 p -68.01 -36.88 80.71 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.47 -40.47 97.19 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.561 -0.712 . . . . 0.01 109.15 179.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.531 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 97.6 mt-10 -59.97 -46.11 90.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.884 . . . . 0.01 109.174 179.389 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -60.44 -40.03 89.67 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.311 -0.996 . . . . 0.01 108.311 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -60.78 -39.86 90.39 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.874 -0.787 . . . . 0.01 108.874 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 48.5 mttm -70.11 -20.13 63.21 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.567 -0.708 . . . . 0.01 110.792 -179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -85.54 -31.5 22.67 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.731 -1.231 . . . . 0.01 110.211 -178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.8 mt -68.63 119.94 15.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 O-C-N 121.051 -1.031 . . . . 0.01 108.625 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -97.47 0.43 47.61 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.429 -0.795 . . . . 0.01 109.341 -179.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.4 m -94.66 110.01 46.77 Favored Pre-proline 0 N--CA 1.495 1.793 0 N-CA-C 108.462 -0.94 . . . . 0.01 108.462 179.539 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -69.87 -10.2 27.9 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 CA-C-N 120.149 1.089 . . . . 0.01 111.78 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.1 p -84.65 -20.58 31.09 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.335 -0.853 . . . . 0.01 109.316 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -94.1 -17.89 22.36 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.296 -0.877 . . . . 0.01 109.703 -179.847 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.45 -39.98 95.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.958 -1.088 . . . . 0.01 109.456 179.671 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.447 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.97 -64.19 1.18 Allowed Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.379 -0.826 . . . . 0.01 111.177 -179.262 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -39.04 -60.22 0.53 Allowed 'Trans proline' 0 N--CA 1.488 1.201 0 C-N-CA 120.934 1.09 . . . . 0.01 112.975 -179.656 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -73.52 -29.08 62.25 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.821 -1.175 . . . . 0.01 110.442 -179.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.94 -48.22 78.83 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.701 -1.249 . . . . 0.01 108.567 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -60.44 -48.07 83.36 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.144 -0.972 . . . . 0.01 108.842 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.97 -49.43 77.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.304 -0.873 . . . . 0.01 108.826 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.9 mt -66.76 -48.36 80.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.398 -0.814 . . . . 0.01 108.864 179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 73' ' ' ILE . 44.1 t80 -60.27 -49.92 75.68 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.424 -0.797 . . . . 0.01 109.574 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -61.29 -39.92 92.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.241 -0.912 . . . . 0.01 109.283 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 86.4 tt0 -77.04 -58.77 3.09 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.53 -0.731 . . . . 0.0 112.325 -178.243 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -91.12 -24.34 20.01 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.605 -1.31 . . . . 0.0 114.159 -176.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CE2' ' A' ' 69' ' ' TYR . 48.4 mm -99.36 -20.26 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.625 0 O-C-N 120.203 -1.561 . . . . 0.01 112.425 -177.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.6 m -58.95 128.16 35.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.072 -1.642 . . . . 0.01 109.394 -179.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.9 m -61.37 -17.8 17.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.255 -0.903 . . . . 0.01 108.799 179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -97.06 -2.79 42.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.425 -0.797 . . . . 0.01 109.334 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -50.2 143.26 8.66 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.266 -0.896 . . . . 0.01 109.699 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.7 p -71.27 -20.7 62.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.263 -0.898 . . . . 0.01 108.864 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -126.45 61.53 1.3 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.187 -0.671 . . . . 0.01 109.187 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.49 140.8 57.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.504 -0.748 . . . . 0.01 109.88 179.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.498 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 31.0 m -99.76 149.8 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.166 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.632 ' ND2' HD21 ' A' ' 42' ' ' ASN . 5.1 p30 -73.72 113.64 11.08 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -178.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HB2' ' HE ' ' A' ' 88' ' ' ARG . 84.5 mt -145.36 164.61 30.96 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 108.288 -1.004 . . . . 0.01 108.288 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.509 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 98.1 m-20 -71.86 158.09 36.69 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.273 -0.892 . . . . 0.01 109.085 179.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 75.5 m -69.81 -19.14 63.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.336 -0.852 . . . . 0.01 109.36 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 49.1 t -83.72 -47.47 11.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.38 -0.825 . . . . 0.01 109.94 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.485 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.1 m -59.96 -41.64 92.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.097 -1.002 . . . . 0.01 109.749 -179.292 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 97.9 mtt180 -60.08 -49.84 76.06 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.09 -1.006 . . . . 0.01 108.835 179.464 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -61.23 -40.74 95.17 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.405 -0.81 . . . . 0.01 109.144 179.179 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.06 -41.41 92.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.528 -0.733 . . . . 0.01 109.825 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 18.3 m -61.87 -40.56 95.79 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.998 -1.064 . . . . 0.01 109.064 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.4 p -60.1 -39.95 87.95 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.826 -0.805 . . . . 0.01 108.826 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.93 -37.37 81.56 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.602 0.715 . . . . 0.01 109.311 179.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -65.23 -18.94 65.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.01 110.553 -178.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 21.4 mmm -59.67 -33.89 72.14 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.826 -1.171 . . . . 0.01 108.315 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 78.6 mt -65.75 -25.43 67.27 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.871 -1.159 . . . . 0.01 107.871 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -144.76 79.34 12.27 Favored Pre-proline 0 N--CA 1.492 1.651 0 N-CA-C 108.371 -0.974 . . . . 0.01 108.371 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -61.92 115.64 2.95 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.313 1.342 . . . . 0.01 112.43 -179.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.2 p -116.42 169.98 8.9 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.644 -0.66 . . . . 0.01 109.35 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 53' ' ' LYS . 9.9 tp -72.55 -20.04 19.4 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.321 -0.862 . . . . 0.01 108.93 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.2 p -95.02 5.12 52.81 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.01 109.946 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.7 t -60.96 -49.01 79.2 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.034 -1.041 . . . . 0.01 110.394 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.41 -8.75 31.54 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.086 -1.009 . . . . 0.01 110.993 -179.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.554 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 85.8 m-20 -59.99 -39.8 86.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.686 -1.258 . . . . 0.01 108.846 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.71 -39.17 87.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.526 -0.734 . . . . 0.01 109.307 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.28 80.81 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.254 -0.904 . . . . 0.0 109.009 -179.783 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -60.08 -41.49 92.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.987 -1.071 . . . . 0.0 109.315 179.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -59.97 -40.11 87.95 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.231 -0.918 . . . . 0.01 108.541 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.509 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 31.1 mmtp -66.32 -39.83 89.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.34 -0.985 . . . . 0.01 108.34 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.528 HG22 ' SD ' ' A' ' 114' ' ' MET . 35.3 mm -66.8 -45.16 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 1.2 m-85 -60.1 -50.72 72.59 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.365 -0.834 . . . . 0.0 108.828 178.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -63.86 -40.88 97.6 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.854 -1.154 . . . . 0.01 109.811 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.3 tp -62.49 -57.54 10.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.778 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.528 ' SD ' HG22 ' A' ' 110' ' ' ILE . 9.2 ptm -66.47 -39.98 89.11 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 109.634 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -67.33 -40.03 85.9 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.154 -0.966 . . . . 0.01 109.426 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 31.6 mmtm -82.82 -10.02 59.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.5 -1.375 . . . . 0.01 110.547 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -121.8 -56.49 1.85 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.23 -0.919 . . . . 0.0 111.567 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' PHE . 38.1 p -64.96 -41.33 95.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.833 -1.167 . . . . 0.01 111.775 -177.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.564 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -57.32 -49.36 76.38 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.856 -1.152 . . . . 0.01 110.912 -178.58 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.442 HH11 ' HG3' ' A' ' 120' ' ' ARG . 19.7 mmm-85 -60.11 -41.18 92.01 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 107.427 -1.323 . . . . 0.01 107.427 -179.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' A' ' 125' ' ' SER . 28.9 mmt180 -70.24 -39.21 75.19 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.106 -0.701 . . . . 0.01 109.106 178.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.462 ' N ' ' O ' ' A' ' 118' ' ' SER . 1.3 t80 -58.68 -49.25 78.25 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.101 -0.999 . . . . 0.01 109.393 -178.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.7 mt -59.4 -37.51 78.18 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.228 -1.027 . . . . 0.01 108.228 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -90.43 -4.17 57.18 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.447 -0.783 . . . . 0.01 109.884 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.7 p -73.79 158.35 34.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.936 -1.102 . . . . 0.01 109.768 -179.278 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -64.87 -39.98 94.4 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.658 -0.651 . . . . 0.01 110.445 -179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -58.69 -49.68 76.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.01 110.41 -178.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.835 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.2 t80 -60.01 -45.89 91.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.671 -1.268 . . . . 0.01 109.375 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.417 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 90.2 mt -60.27 -50.97 71.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.334 -0.854 . . . . 0.01 109.818 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.437 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 95.1 m-20 -60.57 -44.63 95.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.822 -1.174 . . . . 3.77 109.542 179.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.8 mt -69.98 -39.83 75.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 3.8700000000000001 109.471 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.835 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 43.3 p -97.69 65.29 1.85 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.945 . . . . 4.6299999999999999 109.313 179.572 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.437 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 97.8 m-20 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 6.4800000000000004 109.115 -179.722 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 108.448 -0.945 . . . . 18.699999999999999 108.448 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.6 p -77.16 159.34 29.81 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.398 -0.814 . . . . 15.970000000000001 109.512 -179.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -66.76 -25.26 66.4 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.336 -0.987 . . . . 13.82 108.336 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.51 -37.38 80.0 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.578 -0.701 . . . . 15.06 109.83 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.524 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 94.5 mt-10 -70.07 -42.9 72.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.504 -0.747 . . . . 14.68 111.915 -178.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.642 HG21 HG22 ' A' ' 132' ' ' THR . 34.8 m -66.89 -37.97 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.481 -1.387 . . . . 11.69 110.84 -179.142 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -59.06 -32.97 70.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.77 -1.206 . . . . 10.51 109.36 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -60.64 -38.21 84.04 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.947 -1.131 . . . . 10.82 107.947 179.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.524 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.5 m0 -59.8 -27.24 66.41 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.42 -0.955 . . . . 6.2599999999999998 108.42 179.472 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.66 -9.54 58.8 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.066 -1.021 . . . . 0.01 109.111 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -85.42 -38.72 18.36 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.208 -0.933 . . . . 0.01 110.614 -179.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.497 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 18.1 p -170.6 151.82 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.947 -1.095 . . . . 0.01 110.392 -179.21 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.509 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.3 tp -60.07 -41.23 91.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.787 -0.571 . . . . 0.01 110.304 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -50.66 -37.51 41.17 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.218 -0.926 . . . . 0.01 109.507 179.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -66.64 -42.71 86.27 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.916 -1.115 . . . . 0.01 110.979 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.1 tp -60.05 -42.14 93.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.977 -1.077 . . . . 0.01 109.789 -179.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.8 pt -83.93 -17.88 10.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.594 0 O-C-N 121.224 -0.922 . . . . 0.01 110.497 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -93.0 -2.15 56.01 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.904 -1.123 . . . . 0.01 110.082 -179.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.524 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 39.8 t-80 -93.69 138.25 32.1 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.079 -1.013 . . . . 0.01 108.745 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.06 -39.26 85.38 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.512 -0.743 . . . . 0.01 109.527 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.429 ' H ' ' HD1' ' A' ' 23' ' ' HIS . 32.2 t -83.87 -31.57 25.67 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.216 -0.928 . . . . 0.01 109.043 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -60.35 -47.35 91.56 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 107.661 -2.176 . . . . 0.01 107.661 178.255 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -59.85 -48.19 82.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.503 -0.998 . . . . 0.01 109.037 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.89 83.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.292 -0.88 . . . . 0.01 108.634 179.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.57 -42.08 74.99 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.668 -0.645 . . . . 0.01 109.654 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.945 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.9 t80 -63.28 -47.39 82.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.349 -0.844 . . . . 0.0 110.222 -179.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -60.03 -41.99 93.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.757 -1.215 . . . . 0.01 109.356 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.9 80.85 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 179.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 37' ' ' GLU . 75.5 t80 -60.01 -43.04 95.5 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.529 -0.732 . . . . 0.01 109.909 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.945 HD11 ' CE2' ' A' ' 30' ' ' PHE . 67.2 mt -63.31 -40.5 97.49 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.027 -1.045 . . . . 0.0 109.259 -179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -59.99 -40.11 88.04 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.693 -1.225 . . . . 0.01 107.693 178.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.1 m -60.3 -33.68 72.71 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 178.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 33' ' ' PHE . 97.6 mt-10 -101.18 5.03 42.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.687 -0.633 . . . . 0.01 109.964 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.524 ' N ' ' O ' ' A' ' 34' ' ' LEU . 57.6 m-85 57.07 25.85 11.29 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.484 -0.76 . . . . 0.01 110.2 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 p -103.33 29.04 5.87 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 43' ' ' ILE . 21.6 pt-20 -63.38 -21.94 66.58 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.628 -179.558 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.6 pt-20 -62.08 -33.95 75.39 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 120.953 -1.092 . . . . 0.0 108.897 179.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.1 -46.89 88.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.384 -0.823 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 40' ' ' GLU . 8.6 tp -69.91 -39.96 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.006 -1.059 . . . . 0.0 110.109 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -60.66 -41.63 95.39 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.621 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 68.0 t80 -63.91 -40.68 97.04 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.552 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 85.8 t90 -61.94 -43.27 99.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.59 -0.694 . . . . 0.01 109.572 179.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.26 -42.98 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.004 -1.06 . . . . 0.0 109.057 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 p -66.53 -39.98 88.89 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.142 -0.974 . . . . 0.0 109.048 179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.621 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 68.9 m -66.11 -40.12 90.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.01 109.875 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -59.39 -48.65 80.82 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.246 -0.909 . . . . 0.01 108.895 -179.958 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.38 -39.92 89.02 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.649 -1.241 . . . . 0.01 107.649 178.465 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.87 -40.96 94.91 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.394 -0.965 . . . . 0.01 108.394 179.011 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HZ1' ' CB ' ' A' ' 107' ' ' GLN . 58.8 mttp -75.82 -21.04 57.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.371 -0.831 . . . . 0.01 110.814 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -89.2 -20.94 23.57 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.816 -1.177 . . . . 0.01 109.743 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.41 120.58 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.066 -1.022 . . . . 0.01 108.578 178.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -96.23 1.92 52.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.207 -0.933 . . . . 0.01 109.242 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.0 m -96.59 110.3 52.35 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.502 -0.749 . . . . 0.01 109.124 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.01 -7.47 20.93 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 CA-C-N 120.221 1.115 . . . . 0.01 111.932 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.8 p -88.09 -24.69 23.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.416 -0.802 . . . . 0.01 110.193 -179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -88.36 -14.91 36.99 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.878 -1.139 . . . . 0.01 109.738 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.0 mt -62.85 -39.89 95.76 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.177 -0.952 . . . . 0.01 110.173 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.428 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -50.57 -63.31 1.93 Allowed Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.161 -0.962 . . . . 0.01 111.27 -179.325 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.428 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 22.9 Cg_exo -38.33 -59.93 0.51 Allowed 'Trans proline' 0 N--CA 1.489 1.264 0 C-N-CA 121.051 1.167 . . . . 0.01 113.766 -179.325 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -74.01 -22.83 59.43 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.855 -1.153 . . . . 0.01 110.751 -178.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.35 -50.05 75.45 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 120.792 -1.192 . . . . 0.01 109.46 -179.272 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -64.2 -42.39 96.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.121 -0.987 . . . . 0.01 110.002 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -65.89 -46.16 79.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.402 -0.811 . . . . 0.01 109.8 -179.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.9 mt -66.47 -44.33 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.486 -0.931 . . . . 0.01 108.486 179.544 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.551 ' CD2' ' SD ' ' A' ' 95' ' ' MET . 59.6 t80 -61.4 -49.89 75.07 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.487 -0.758 . . . . 0.01 109.28 179.174 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OG ' ' A' ' 74' ' ' SER . 94.1 m-20 -67.25 -37.97 84.4 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.632 -0.668 . . . . 0.01 110.133 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -76.56 -24.26 53.57 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.301 -0.875 . . . . 0.0 112.082 -178.307 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.4 -24.75 2.24 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.615 -1.303 . . . . 0.0 113.419 -177.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.8 mm -104.28 -30.1 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 120.563 -1.336 . . . . 0.01 112.253 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 11.9 p -60.21 139.98 57.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.204 -1.56 . . . . 0.01 109.611 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.8 m -59.22 -10.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.398 -0.814 . . . . 0.01 108.806 179.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -99.39 -0.1 41.64 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.408 -0.807 . . . . 0.01 109.675 -179.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.64 142.67 8.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.01 109.251 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.1 p -69.63 -23.79 63.55 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.02 . . . . 0.01 108.732 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -137.4 83.79 2.01 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.98 -0.748 . . . . 0.01 108.98 179.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.7 mt-10 -61.78 140.85 58.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.01 109.857 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 m -94.8 151.82 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 109.437 -179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.2 OUTLIER -75.13 104.49 5.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.593 -179.53 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.3 mt -145.41 164.5 31.34 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.175 -1.046 . . . . 0.01 108.175 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.467 ' OD1' ' OG1' ' A' ' 87' ' ' THR . 38.8 p-10 -74.73 170.05 16.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.827 -1.17 . . . . 0.01 109.603 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.9 t -70.04 -22.05 63.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.389 -0.82 . . . . 0.01 110.433 -179.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 82.7 m -83.77 -37.32 22.76 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.052 -1.03 . . . . 0.01 111.059 -178.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.467 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 95.5 m -60.22 -46.18 90.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.739 -1.226 . . . . 0.01 109.919 -179.317 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.404 HH11 ' HG3' ' A' ' 88' ' ' ARG . 52.2 mtm-85 -60.14 -48.1 83.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.993 -1.067 . . . . 0.01 108.824 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.25 -40.08 89.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.133 -0.979 . . . . 0.01 109.596 179.352 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 105' ' ' GLU . 35.4 mt-10 -60.1 -40.02 88.18 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.012 -1.055 . . . . 0.01 109.757 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.6 m -62.06 -42.48 99.24 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.006 -1.059 . . . . 0.01 108.772 -179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.8 p -59.74 -45.38 92.36 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.824 . . . . 0.01 109.856 -179.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.404 HH21 ' CG ' ' A' ' 90' ' ' GLU . 86.6 mtm180 -67.71 -40.58 84.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.111 -0.993 . . . . 0.01 109.288 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -61.46 -39.59 91.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.531 -0.731 . . . . 0.01 109.304 179.216 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.551 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 78.6 mtp -56.54 -27.99 58.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.813 . . . . 0.01 109.475 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 74.2 mt -65.34 -22.42 66.81 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.391 -1.337 . . . . 0.01 107.391 178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -141.59 80.45 16.08 Favored Pre-proline 0 N--CA 1.494 1.751 0 N-CA-C 107.642 -1.244 . . . . 0.01 107.642 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -56.8 110.1 0.54 Allowed 'Trans proline' 0 N--CA 1.489 1.249 0 C-N-CA 120.863 1.042 . . . . 0.01 112.323 -178.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.9 p -125.71 172.15 10.03 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.521 -0.918 . . . . 0.01 108.521 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.5 tp -70.01 -20.02 22.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 O-C-N 121.194 -0.942 . . . . 0.01 109.132 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.0 p -92.94 5.65 50.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.29 -0.881 . . . . 0.01 109.645 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.3 t -61.39 -63.09 1.4 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.314 -0.866 . . . . 0.01 110.786 -179.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -93.4 -1.0 56.32 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.988 -1.07 . . . . 0.01 111.082 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -60.8 -39.99 90.96 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.728 -1.232 . . . . 0.01 109.061 179.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.436 ' OE2' ' OE2' ' A' ' 90' ' ' GLU . 89.1 tt0 -63.29 -39.44 94.59 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.478 -0.764 . . . . 0.01 109.405 -179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.5 -45.81 71.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.192 -0.943 . . . . 0.0 109.734 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.479 ' CB ' ' HZ1' ' A' ' 53' ' ' LYS . 21.3 tt0 -60.49 -40.03 89.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.631 -1.293 . . . . 0.0 108.71 179.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -58.92 -40.12 83.61 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.203 -1.036 . . . . 0.01 108.203 -179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -64.38 -39.88 94.73 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.413 -0.804 . . . . 0.01 108.949 179.516 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.2 mm -66.85 -40.56 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.509 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.8 m-85 -60.09 -49.24 78.44 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.044 -1.035 . . . . 0.0 108.212 178.363 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -63.57 -39.95 95.7 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.94 -1.1 . . . . 0.01 110.594 -179.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.4 tp -61.24 -59.69 4.91 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.651 -1.281 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.418 ' O ' ' N ' ' A' ' 118' ' ' SER . 3.5 ptm -67.17 -39.56 86.46 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.363 -0.836 . . . . 0.0 110.31 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -60.68 -46.21 91.23 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.977 -1.077 . . . . 0.01 110.339 -179.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 116' ' ' LYS . 12.9 mptt -80.84 -12.4 59.43 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.793 -1.192 . . . . 0.01 111.053 -179.125 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -121.9 -59.83 1.64 Allowed 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.017 -1.052 . . . . 0.0 111.305 -178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.48 ' O ' ' N ' ' A' ' 122' ' ' PHE . 30.3 p -59.26 -45.63 90.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.121 -0.987 . . . . 0.01 111.327 -177.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.524 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -56.55 -52.21 65.67 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.839 -1.163 . . . . 0.01 110.867 -178.64 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.506 ' HG2' HH11 ' A' ' 120' ' ' ARG . 26.5 mtt-85 -59.98 -40.16 88.17 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 107.76 -1.2 . . . . 0.01 107.76 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.572 ' O ' ' N ' ' A' ' 125' ' ' SER . 85.8 mtm180 -69.99 -39.92 75.62 Favored 'General case' 0 C--N 1.294 -1.815 0 C-N-CA 119.123 -1.031 . . . . 0.01 108.35 178.561 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -59.36 -54.9 41.49 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.16 -0.962 . . . . 0.01 109.125 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.409 HD23 ' CE1' ' A' ' 128' ' ' TYR . 81.7 mt -57.78 -36.03 71.6 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.125 -0.984 . . . . 0.01 108.463 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -95.92 9.99 38.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.483 -0.761 . . . . 0.01 109.711 -179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.572 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -82.23 162.11 22.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.996 -1.065 . . . . 0.01 109.496 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.51 -40.31 95.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.494 -0.754 . . . . 0.01 109.739 179.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -62.51 -50.55 70.95 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.01 110.785 -178.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.817 ' CZ ' HG21 ' A' ' 132' ' ' THR . 66.0 t80 -59.72 -49.48 77.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.916 -1.115 . . . . 0.01 108.92 -179.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.519 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 81.2 mt -60.09 -48.91 79.75 Favored 'General case' 0 C--N 1.299 -1.607 0 C-N-CA 119.209 -0.997 . . . . 0.01 108.321 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 92.8 m-20 -60.08 -43.84 95.19 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.227 -0.921 . . . . 3.77 108.538 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.7 mt -70.14 -38.57 75.53 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.087 -1.008 . . . . 3.8700000000000001 109.368 178.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.817 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 25.3 p -102.45 62.19 0.85 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.418 -0.801 . . . . 4.6299999999999999 110.063 -179.23 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.519 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 15.7 m120 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.136 -0.977 . . . . 6.4800000000000004 109.195 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.461 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 15.7 t . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 121.419 0.628 . . . . 18.699999999999999 109.596 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 84.6 p -79.91 170.1 16.95 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.424 -0.798 . . . . 15.970000000000001 109.776 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 9.0 mp0 -70.09 -18.12 63.25 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.809 0.814 . . . . 13.82 108.994 179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.59 -39.7 77.14 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 121.077 -1.014 . . . . 15.06 109.235 179.495 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.506 ' OE1' ' NE2' ' A' ' 23' ' ' HIS . 97.1 mt-10 -74.06 -41.41 61.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.607 -0.683 . . . . 14.68 112.188 -177.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.591 HG21 HG22 ' A' ' 132' ' ' THR . 34.1 m -61.85 -39.37 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 120.536 -1.352 . . . . 11.69 109.938 -178.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' N ' HG23 ' A' ' 10' ' ' VAL . 59.3 mttp -60.0 -39.6 86.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.787 -1.195 . . . . 10.51 109.173 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -59.94 -39.63 86.19 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.377 -0.971 . . . . 10.82 108.377 179.036 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 37.7 m0 -59.95 -30.24 68.94 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.346 -0.983 . . . . 6.2599999999999998 108.346 179.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.05 -8.28 59.74 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.732 -1.23 . . . . 0.01 108.864 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -92.44 -32.98 14.71 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.288 -0.883 . . . . 0.01 110.71 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.491 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 83.1 p -170.56 147.67 2.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.781 -1.199 . . . . 0.01 111.051 -179.311 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.4 tp -60.05 -39.83 87.35 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.471 -0.566 . . . . 0.01 109.471 179.28 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -49.17 -44.44 42.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.597 -0.689 . . . . 0.01 110.437 -178.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.61 -43.37 94.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.022 -1.049 . . . . 0.01 110.785 -179.383 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.9 tp -60.16 -49.81 76.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.965 -1.084 . . . . 0.01 109.749 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 32.3 pt -74.06 -20.0 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 120.962 -1.086 . . . . 0.01 110.419 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -87.62 -6.72 58.15 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.005 -1.06 . . . . 0.01 110.258 -179.268 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.506 ' NE2' ' OE1' ' A' ' 9' ' ' GLU . 41.0 t-80 -92.79 139.06 30.94 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.929 -1.107 . . . . 0.01 109.374 179.653 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -59.86 -40.08 87.38 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.465 -0.772 . . . . 0.01 110.285 -179.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.461 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 8.8 t -83.34 -26.77 30.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.993 -1.067 . . . . 0.01 108.689 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -62.09 -49.7 72.54 Favored Glycine 0 N--CA 1.484 1.837 0 N-CA-C 107.786 -2.125 . . . . 0.01 107.786 178.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.96 -46.45 89.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.391 -1.064 . . . . 0.01 109.087 178.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.89 75.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.96 -1.088 . . . . 0.01 109.211 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.86 64.87 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.275 -0.89 . . . . 0.01 109.139 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.837 ' CE2' HD11 ' A' ' 34' ' ' LEU . 68.1 t80 -60.04 -45.85 91.47 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.46 -0.775 . . . . 0.0 109.901 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -59.87 -39.27 84.72 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.217 -1.031 . . . . 0.01 108.217 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.27 82.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.345 -0.847 . . . . 0.01 109.034 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.09 -40.36 89.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.181 -0.949 . . . . 0.01 109.55 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.837 HD11 ' CE2' ' A' ' 30' ' ' PHE . 90.7 mt -60.11 -40.05 88.35 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -60.1 -37.26 79.44 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 109.274 -0.639 . . . . 0.01 109.274 179.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.6 m -60.11 -36.1 76.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.333 -0.854 . . . . 0.0 108.904 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -100.12 11.47 39.26 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.498 -0.927 . . . . 0.01 108.498 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 57.53 27.79 14.6 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.445 0.641 . . . . 0.01 109.426 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -100.21 22.56 11.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.491 -0.756 . . . . 0.0 109.018 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 43' ' ' ILE . 19.8 pt-20 -62.86 -26.7 68.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.156 -0.965 . . . . 0.0 109.26 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 19.2 pt-20 -60.67 -28.83 68.9 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 120.75 -1.219 . . . . 0.0 108.692 179.273 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.523 HD21 ' ND2' ' A' ' 82' ' ' ASN . 5.1 m120 -60.11 -43.38 95.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 110.511 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.413 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.4 tp -70.09 -39.94 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 120.64 -1.287 . . . . 0.0 108.793 -179.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.15 -43.07 96.04 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.603 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 79.7 t80 -62.75 -43.36 99.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.236 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.521 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 37.6 t90 -59.99 -44.08 94.74 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.618 -0.676 . . . . 0.01 109.882 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.8 mt -60.07 -42.54 90.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.148 -0.97 . . . . 0.0 108.911 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 84.7 p -65.78 -38.08 88.06 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.603 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 63.0 m -66.39 -39.15 88.86 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.667 -0.645 . . . . 0.01 109.521 179.291 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.521 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 43.5 mt-10 -55.87 -50.04 71.7 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.903 -1.123 . . . . 0.01 108.887 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.15 -39.97 88.22 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.923 -1.111 . . . . 0.01 108.158 178.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -62.57 -39.97 95.37 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.586 -0.696 . . . . 0.01 109.435 179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.614 ' HZ1' ' C ' ' A' ' 103' ' ' PHE . 14.7 mmtm -75.05 -12.96 60.44 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.801 . . . . 0.01 110.341 -179.169 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -94.21 -25.61 17.01 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.028 -1.045 . . . . 0.01 109.226 179.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 90.4 mt -76.07 119.0 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.171 -0.956 . . . . 0.01 108.861 178.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -99.3 0.27 42.68 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.109 -0.994 . . . . 0.01 109.748 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.7 m -93.47 111.86 54.1 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.341 -0.849 . . . . 0.01 109.191 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.72 -4.66 13.66 Favored 'Trans proline' 0 N--CA 1.491 1.327 0 CA-C-N 120.185 1.102 . . . . 0.01 111.914 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 83.1 p -85.99 -24.95 26.27 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.298 -0.876 . . . . 0.01 109.902 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -92.75 -18.83 22.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.162 -0.961 . . . . 0.01 109.745 -179.621 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.69 -39.9 95.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.119 -0.988 . . . . 0.01 109.378 179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.464 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.66 -64.92 0.86 Allowed Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.294 -0.879 . . . . 0.01 111.165 -179.145 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.464 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 6.0 Cg_exo -43.22 -61.1 0.61 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 120.887 1.058 . . . . 0.01 113.153 -179.353 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -72.66 -27.57 62.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.108 -0.995 . . . . 0.01 110.617 -178.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.88 79.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.9 -1.125 . . . . 0.01 109.132 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -59.96 -43.83 94.81 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.287 -0.883 . . . . 0.01 108.873 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -63.71 -49.96 71.04 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.418 -0.801 . . . . 0.01 109.455 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 87.3 mt -62.11 -49.87 82.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.172 -0.955 . . . . 0.01 108.748 179.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.568 ' CE2' HG21 ' A' ' 73' ' ' ILE . 56.1 t80 -60.73 -49.97 75.35 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.7 0.762 . . . . 0.01 109.82 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -61.93 -39.96 93.85 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.163 -0.961 . . . . 0.01 110.175 -179.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -76.8 -59.47 2.76 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 120.748 -1.22 . . . . 0.0 111.576 -178.388 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -84.74 -34.24 22.9 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.568 HG21 ' CE2' ' A' ' 69' ' ' TYR . 50.1 mm -96.97 -12.13 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 120.503 -1.373 . . . . 0.01 112.694 -176.519 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.4 p -59.83 130.59 47.52 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.028 -1.67 . . . . 0.01 108.74 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.5 m -59.99 -16.08 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.178 -0.951 . . . . 0.01 108.614 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -99.85 3.48 44.65 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.916 -0.772 . . . . 0.01 108.916 179.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.75 140.33 6.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.543 -0.723 . . . . 0.01 109.984 -179.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.7 p -69.94 -20.04 63.35 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.467 -0.938 . . . . 0.01 108.467 179.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -135.74 76.85 1.63 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.737 0.779 . . . . 0.01 109.111 179.331 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 46.3 mt-10 -60.04 140.06 57.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.077 . . . . 0.01 109.502 -179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.5 m -88.62 154.68 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 108.924 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.585 ' N ' HD22 ' A' ' 82' ' ' ASN . 0.0 OUTLIER -75.61 97.46 3.78 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.967 -179.257 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.4 HD21 HD11 ' A' ' 110' ' ' ILE . 91.0 mt -141.21 154.95 46.07 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.297 -1.001 . . . . 0.01 108.297 179.442 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.504 ' OD2' ' SG ' ' A' ' 86' ' ' CYS . 42.1 p30 -73.37 166.7 22.7 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.046 -1.034 . . . . 0.01 108.989 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.1 t -68.83 -22.55 64.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.15 -0.969 . . . . 0.01 110.764 -178.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.504 ' SG ' ' OD2' ' A' ' 84' ' ' ASP . 22.4 p -82.45 -42.35 18.64 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.679 -1.263 . . . . 0.01 110.581 -178.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.501 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 89.4 m -60.07 -45.2 93.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.908 -1.12 . . . . 0.01 110.188 -179.22 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -60.12 -44.13 95.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.952 -1.092 . . . . 0.01 109.3 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.98 -41.97 93.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.01 109.417 179.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.92 -40.1 87.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.01 110.202 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 m -62.45 -41.15 98.54 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.875 -1.141 . . . . 0.01 108.458 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.1 p -60.06 -39.22 85.25 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.456 0.646 . . . . 0.01 109.453 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -65.61 -40.02 92.16 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.35 -0.844 . . . . 0.01 110.233 -179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.06 -19.0 65.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.383 -0.823 . . . . 0.01 110.609 -178.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.5 mmm -59.91 -30.98 69.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.914 -1.116 . . . . 0.01 108.688 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.97 -30.88 71.12 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.398 -0.964 . . . . 0.01 108.398 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -137.86 76.58 40.12 Favored Pre-proline 0 N--CA 1.494 1.744 0 N-CA-C 108.154 -1.054 . . . . 0.01 108.154 179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -59.93 116.18 3.13 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 121.375 1.383 . . . . 0.01 112.128 -178.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 p -133.16 176.23 8.69 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.548 0.689 . . . . 0.01 109.658 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -70.58 -19.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 121.537 -0.727 . . . . 0.01 109.123 179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -93.02 0.91 57.48 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.295 -0.878 . . . . 0.01 109.486 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.426 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.8 t -59.37 -51.49 69.7 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.469 -0.769 . . . . 0.01 110.186 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.614 ' C ' ' HZ1' ' A' ' 53' ' ' LYS . 44.9 m-85 -98.08 0.07 45.44 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.289 -0.882 . . . . 0.01 111.163 -178.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' A' ' 53' ' ' LYS . 83.2 m-20 -59.99 -40.09 87.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.455 -1.403 . . . . 0.01 108.236 179.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -67.24 -39.77 86.24 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.95 -54.28 14.05 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.667 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.4 ' OE1' ' CE ' ' A' ' 53' ' ' LYS . 53.0 tt0 -60.02 -41.52 92.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.88 -1.138 . . . . 0.0 108.832 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.03 -40.02 87.92 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.097 -1.075 . . . . 0.01 108.097 179.2 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -61.01 -39.93 91.62 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.642 -0.873 . . . . 0.01 108.642 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 HD21 ' A' ' 83' ' ' LEU . 45.5 mm -66.77 -42.15 88.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.277 -0.89 . . . . 0.0 109.328 179.901 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -59.96 -49.48 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.833 -1.167 . . . . 0.0 108.657 179.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.73 -44.42 81.58 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.14 -0.975 . . . . 0.01 110.064 -179.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.79 -54.21 47.94 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.98 -1.075 . . . . 0.0 110.725 -178.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 8.5 ptm -64.97 -38.72 91.88 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.968 -1.083 . . . . 0.0 109.096 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -65.1 -43.33 92.42 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.112 -0.993 . . . . 0.01 110.363 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.98 -34.25 73.11 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.347 -1.47 . . . . 0.01 111.497 -179.096 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -102.14 -40.4 6.83 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.999 -1.063 . . . . 0.0 112.268 -178.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 122' ' ' PHE . 22.3 p -81.46 -50.32 9.57 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.467 -1.396 . . . . 0.01 112.523 -178.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.533 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -52.33 -53.72 40.8 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.77 -1.207 . . . . 0.01 111.192 -177.57 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -59.95 -40.6 89.56 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.627 -1.295 . . . . 0.01 108.139 -179.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 125' ' ' SER . 29.9 mmt180 -70.11 -36.24 74.69 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.535 -0.728 . . . . 0.01 109.071 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.543 ' N ' ' O ' ' A' ' 118' ' ' SER . 2.0 t80 -57.63 -51.99 67.26 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.419 -0.801 . . . . 0.01 110.035 -178.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.1 mt -59.93 -35.42 74.86 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.108 -1.071 . . . . 0.01 108.108 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -89.99 0.03 57.32 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.575 -0.703 . . . . 0.01 109.256 179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.544 ' N ' ' O ' ' A' ' 121' ' ' ARG . 65.4 m -78.53 163.5 25.49 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.105 -0.997 . . . . 0.01 109.884 -179.567 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.512 ' H ' ' CD ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.41 -36.2 78.77 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.505 -0.747 . . . . 0.01 109.627 -179.893 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -60.04 -49.86 76.01 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.347 -0.846 . . . . 0.01 110.498 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.506 ' CZ ' HG21 ' A' ' 132' ' ' THR . 48.1 t80 -68.84 -44.49 73.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.02 -1.05 . . . . 0.01 109.494 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.93 -41.09 95.55 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.556 -0.715 . . . . 0.01 109.513 -179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.448 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.1 m-20 -60.06 -48.96 79.55 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.111 -0.993 . . . . 3.77 108.854 179.606 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.95 -40.06 75.66 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.537 -0.912 . . . . 3.8700000000000001 108.537 179.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.591 HG22 HG21 ' A' ' 10' ' ' VAL . 4.5 p -116.85 82.98 1.89 Allowed 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.822 0.82 . . . . 4.6299999999999999 108.797 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.603 HD22 ' H ' ' A' ' 133' ' ' ASN . 1.1 m-80 . . . . . 0 C--N 1.295 -1.783 0 O-C-N 120.976 -1.077 . . . . 6.4800000000000004 108.254 -179.554 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 108.557 -0.905 . . . . 18.699999999999999 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 80.4 p -74.19 156.81 36.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.067 -1.021 . . . . 15.970000000000001 110.087 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -72.49 -21.11 61.26 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.691 0.758 . . . . 13.82 109.134 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.97 -39.23 76.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.969 -1.082 . . . . 15.06 110.507 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.548 ' CD ' ' HE2' ' A' ' 23' ' ' HIS . 97.3 mt-10 -70.89 -44.27 66.62 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.142 -0.974 . . . . 14.68 111.657 -177.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 HG22 ' A' ' 132' ' ' THR . 31.4 m -61.91 -39.28 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.083 -1.011 . . . . 11.69 110.344 -179.122 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 8.1 mmmm -60.14 -32.79 71.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.592 -1.318 . . . . 10.51 109.224 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.4 mtpm? -62.66 -30.62 71.52 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.946 -1.131 . . . . 10.82 107.946 179.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.532 ' O ' ' CE2' ' A' ' 119' ' ' TYR . 37.4 m0 -59.78 -32.36 70.54 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.234 -1.025 . . . . 6.2599999999999998 108.234 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.74 59.52 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.13 -0.981 . . . . 0.01 108.78 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -88.92 -36.16 16.07 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.293 -0.879 . . . . 0.01 110.922 -179.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.494 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 26.4 p -172.04 145.25 1.79 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.569 -1.332 . . . . 0.01 111.352 -178.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.579 HD23 ' CD2' ' A' ' 111' ' ' PHE . 55.7 tp -59.89 -44.54 94.18 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.815 -0.553 . . . . 0.01 110.467 179.789 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -50.32 -40.99 50.4 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.01 -1.056 . . . . 0.01 109.087 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.494 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 98.3 m-20 -64.46 -44.83 89.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.57 -0.706 . . . . 0.01 110.65 -179.495 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.04 -48.68 80.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.739 -1.225 . . . . 0.01 109.319 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.605 ' O ' HD21 ' A' ' 27' ' ' LEU . 11.6 tt -79.74 -20.44 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.01 -1.056 . . . . 0.01 111.303 -178.428 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -92.65 -3.65 54.57 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.39 -1.444 . . . . 0.01 110.397 -179.236 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.548 ' HE2' ' CD ' ' A' ' 9' ' ' GLU . 59.3 t-80 -92.92 141.01 28.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.168 -0.958 . . . . 0.01 109.294 -179.405 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.95 -39.92 87.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.222 -0.924 . . . . 0.01 109.906 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 37.6 t -82.97 -37.95 23.37 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.976 -1.078 . . . . 0.01 108.597 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.95 -40.08 96.42 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 107.624 -2.19 . . . . 0.01 107.624 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.605 HD21 ' O ' ' A' ' 21' ' ' ILE . 29.6 mt -60.02 -50.6 73.11 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.396 -1.061 . . . . 0.01 108.575 178.278 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.12 -45.2 93.78 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.166 -0.959 . . . . 0.01 109.066 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.56 -47.33 73.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.246 -1.02 . . . . 0.01 108.246 179.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.8 ' CE2' HD11 ' A' ' 34' ' ' LEU . 51.2 t80 -60.63 -49.06 79.05 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.666 -0.646 . . . . 0.0 109.741 179.777 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.49 -39.89 85.23 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.78 -1.2 . . . . 0.01 108.993 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.22 83.18 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.068 -1.086 . . . . 0.01 108.068 178.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -59.98 -42.94 95.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.356 -0.84 . . . . 0.01 109.463 178.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 30' ' ' PHE . 85.2 mt -60.21 -39.43 86.55 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -59.4 -40.01 85.26 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.515 -0.92 . . . . 0.01 108.515 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 m -60.11 -38.73 83.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.11 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -98.94 6.61 46.65 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.429 -0.795 . . . . 0.01 109.024 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 34' ' ' LEU . 93.4 m-85 56.31 29.66 15.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.657 -0.652 . . . . 0.01 109.853 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 p -101.93 30.44 4.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.472 -0.768 . . . . 0.0 109.028 179.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -65.92 -18.17 65.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.199 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -63.34 -33.08 74.75 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.789 -1.194 . . . . 0.0 107.988 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.83 -50.05 75.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.574 -0.704 . . . . 0.0 110.964 -179.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.1 tp -68.89 -40.24 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 120.465 -1.397 . . . . 0.0 109.031 -179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -63.39 -45.53 90.61 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -66.69 -39.63 88.19 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.483 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.46 ' CZ3' ' OE1' ' A' ' 50' ' ' GLU . 60.4 t90 -59.98 -42.33 93.92 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.644 -0.822 . . . . 0.01 108.948 -179.599 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.0 mt -63.57 -39.85 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.4 p -66.68 -45.98 77.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.312 -0.868 . . . . 0.0 109.031 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.0 p -69.8 -32.19 70.51 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.281 -0.887 . . . . 0.01 109.131 179.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.46 ' OE1' ' CZ3' ' A' ' 46' ' ' TRP . 86.3 tt0 -59.8 -47.04 87.31 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.295 -1.002 . . . . 0.01 108.295 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.42 -39.97 92.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.563 -0.903 . . . . 0.01 108.563 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.458 ' CD2' ' NZ ' ' A' ' 64' ' ' LYS . 27.0 t80 -60.12 -43.24 95.79 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.397 0.617 . . . . 0.01 109.528 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' NZ ' ' OE1' ' A' ' 107' ' ' GLN . 33.1 mtpt -70.51 -16.93 62.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.01 110.51 -179.061 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.2 mttm -88.28 -28.16 21.26 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.765 -1.209 . . . . 0.01 109.483 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.7 mt -71.21 120.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 120.969 -1.082 . . . . 0.01 108.542 178.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -98.93 -0.29 42.54 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.235 -0.915 . . . . 0.01 109.907 -179.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -95.66 111.28 55.13 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.424 -0.798 . . . . 0.01 109.014 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -68.52 -0.86 6.46 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 CA-C-N 120.113 1.076 . . . . 0.01 111.324 -179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.9 p -87.58 -30.43 20.52 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.446 -0.783 . . . . 0.01 109.971 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -90.04 -12.28 38.97 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.957 -1.089 . . . . 0.01 110.107 -179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.2 mt -65.64 -39.91 91.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.962 -1.086 . . . . 0.01 109.402 179.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.446 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -46.73 -63.68 1.27 Allowed Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.63 -0.669 . . . . 0.01 111.051 -179.369 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 25.5 Cg_exo -36.6 -66.98 0.11 Allowed 'Trans proline' 0 N--CA 1.487 1.1 0 C-N-CA 121.262 1.308 . . . . 0.01 114.102 -179.722 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.458 ' NZ ' ' CD2' ' A' ' 52' ' ' TYR . 15.7 pttm -79.28 -16.51 56.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.706 -1.246 . . . . 0.01 111.182 -178.507 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.94 -51.07 71.25 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.459 -1.401 . . . . 0.01 108.746 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 63.5 mttp -65.11 -42.91 93.54 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.479 -0.763 . . . . 0.01 109.961 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -65.13 -47.6 76.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.1 -1.0 . . . . 0.01 109.565 -179.429 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.95 -49.97 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.107 -0.995 . . . . 0.01 108.979 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.663 ' CE2' HG21 ' A' ' 73' ' ' ILE . 45.6 t80 -60.76 -50.05 75.01 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.501 -0.749 . . . . 0.01 109.268 179.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.453 ' O ' ' OG ' ' A' ' 74' ' ' SER . 26.5 m120 -61.22 -39.96 92.23 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.7 -0.625 . . . . 0.01 109.492 -179.33 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -81.62 -53.9 5.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.895 -1.128 . . . . 0.0 111.249 -179.131 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -86.2 -36.04 19.7 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.69 -1.256 . . . . 0.0 113.736 -177.182 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.663 HG21 ' CE2' ' A' ' 69' ' ' TYR . 7.6 mm -94.8 -11.54 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 120.386 -1.447 . . . . 0.01 112.333 -176.609 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 21.0 m -59.96 130.08 44.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.167 -1.583 . . . . 0.01 109.368 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -59.8 -16.63 11.56 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.21 -1.033 . . . . 0.01 108.21 179.331 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -96.12 -2.43 46.54 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 108.804 -0.813 . . . . 0.01 108.804 179.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.2 140.3 9.87 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.38 -0.825 . . . . 0.01 109.812 -179.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 53.8 p -70.04 -21.67 63.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.362 -0.836 . . . . 0.01 108.855 179.66 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.0 pttm -128.5 72.42 1.44 Allowed 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -59.98 139.95 57.07 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.371 -0.831 . . . . 0.01 109.021 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 5.1 m -94.55 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.464 -0.773 . . . . 0.0 109.205 -179.735 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -74.21 105.36 5.37 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.394 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.4 mt -145.19 166.23 26.04 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.409 -0.96 . . . . 0.01 108.409 -179.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.514 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 97.6 m-20 -71.83 159.71 33.83 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.063 -1.023 . . . . 0.01 108.979 179.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.8 m -68.05 -25.98 65.63 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.145 -0.972 . . . . 0.01 108.973 179.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 10.1 m -83.21 -33.13 26.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.312 -0.868 . . . . 0.01 109.536 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.48 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 94.0 m -60.03 -46.49 89.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.163 -0.96 . . . . 0.01 108.595 179.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 99.1 mtt180 -61.53 -46.75 88.61 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.393 -0.966 . . . . 0.01 108.393 179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.31 -39.87 88.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 108.597 -0.89 . . . . 0.01 108.597 179.056 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.425 ' HA ' ' HE ' ' A' ' 93' ' ' ARG . 86.4 tt0 -59.88 -40.58 89.19 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.516 -0.92 . . . . 0.01 108.516 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 19.4 m -63.73 -41.2 98.08 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.705 -0.85 . . . . 0.01 108.705 179.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 56.0 p -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.386 -0.821 . . . . 0.01 109.22 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.425 ' HE ' ' HA ' ' A' ' 90' ' ' GLU . 83.9 mtm180 -67.17 -40.0 86.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.056 -1.028 . . . . 0.01 108.573 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.405 ' O ' ' C ' ' A' ' 97' ' ' GLU . 96.2 m-20 -63.35 -38.34 90.78 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.805 -0.813 . . . . 0.01 108.805 179.235 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.561 ' SD ' ' CD2' ' A' ' 69' ' ' TYR . 67.4 mtp -59.28 -31.28 68.97 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.274 -0.891 . . . . 0.01 109.728 -179.818 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.66 -22.72 67.05 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.121 -1.437 . . . . 0.01 107.121 178.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' ASN . 81.5 mt-10 -142.47 80.54 14.48 Favored Pre-proline 0 N--CA 1.492 1.631 0 N-CA-C 107.446 -1.316 . . . . 0.01 107.446 179.535 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -53.07 114.16 1.6 Allowed 'Trans proline' 0 N--CA 1.489 1.256 0 C-N-CA 120.869 1.046 . . . . 0.01 112.788 -177.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.0 p -127.26 168.07 15.24 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.298 -1.001 . . . . 0.01 108.298 179.573 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' O ' ' OD1' ' A' ' 104' ' ' ASP . 10.4 tp -70.47 -19.05 21.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.178 -0.951 . . . . 0.01 109.529 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -93.13 9.03 37.66 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.132 -0.98 . . . . 0.01 109.773 -179.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.57 -66.32 0.55 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.203 -0.935 . . . . 0.01 111.055 -179.455 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -91.79 -0.19 57.52 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.184 -0.948 . . . . 0.01 110.859 -178.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' A' ' 100' ' ' ILE . 5.1 m-20 -60.19 -40.07 88.72 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.755 -1.216 . . . . 0.01 108.801 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 50.9 tp10 -63.47 -39.96 95.84 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.555 -0.716 . . . . 0.01 109.65 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.031 -1.043 . . . . 0.0 109.146 -179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.436 ' OE1' ' NZ ' ' A' ' 53' ' ' LYS . 48.7 tt0 -59.65 -43.03 94.07 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.14 -0.975 . . . . 0.0 108.631 179.645 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -59.74 -41.19 90.38 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.418 -0.801 . . . . 0.01 109.163 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.514 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 28.7 mmtp -62.93 -39.12 93.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.448 -0.783 . . . . 0.01 109.096 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.545 HG22 ' SD ' ' A' ' 114' ' ' MET . 46.6 mm -64.96 -48.79 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.008 -1.057 . . . . 0.0 108.255 179.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.579 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.6 m-85 -60.48 -50.26 74.29 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 109.219 179.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.84 -40.99 94.95 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.14 -0.975 . . . . 0.01 109.526 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 63.7 tp -62.0 -57.16 12.72 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.465 -0.772 . . . . 0.0 110.352 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 110' ' ' ILE . 1.6 ptm -69.81 -38.52 76.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.985 -1.072 . . . . 0.0 110.352 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -60.15 -46.38 89.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.9 -1.125 . . . . 0.01 110.196 -179.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -71.28 -38.51 71.83 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 120.736 -1.227 . . . . 0.01 111.279 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.05 -55.83 2.34 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.014 -1.054 . . . . 0.0 112.643 -177.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 122' ' ' PHE . 19.8 p -58.15 -48.9 78.82 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.628 -1.295 . . . . 0.01 111.379 -177.259 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -58.03 -50.0 74.94 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.805 -1.184 . . . . 0.01 110.529 -178.801 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 26.0 mmt-85 -60.75 -40.02 90.89 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.743 -1.206 . . . . 0.01 107.743 -179.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.563 ' O ' ' N ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -69.89 -39.99 75.91 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.298 -0.876 . . . . 0.01 109.39 178.642 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.435 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.6 OUTLIER -54.46 -51.39 65.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.106 -0.996 . . . . 0.01 109.637 -179.007 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.38 -39.82 88.62 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.396 -0.815 . . . . 0.01 108.929 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.79 -4.53 58.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.363 -0.836 . . . . 0.01 110.112 -179.303 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 121' ' ' ARG . 40.7 t -85.07 166.83 16.34 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.032 -1.042 . . . . 0.01 110.422 -179.215 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -65.66 -28.25 68.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.309 -0.87 . . . . 0.01 110.912 -179.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -60.09 -51.14 70.87 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 120.831 -1.168 . . . . 0.01 110.046 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 132' ' ' THR . 62.0 t80 -72.57 -42.62 64.41 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.297 -0.877 . . . . 0.01 109.931 -179.578 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.61 -52.29 63.95 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.899 -1.126 . . . . 0.01 109.73 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -60.5 -51.75 68.1 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.18 -0.95 . . . . 3.77 109.803 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.27 -40.85 74.09 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.336 -0.853 . . . . 3.8700000000000001 109.2 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 128' ' ' TYR . 4.0 p -119.98 83.27 2.02 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.383 -0.969 . . . . 4.6299999999999999 108.383 179.159 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.2 m120 . . . . . 0 C--N 1.296 -1.734 0 O-C-N 120.421 -1.425 . . . . 6.4800000000000004 108.566 -179.424 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.498 1.971 0 N-CA-C 109.062 -0.718 . . . . 18.699999999999999 109.062 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 83.7 p -72.02 157.39 37.89 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.257 -0.902 . . . . 15.970000000000001 109.595 -179.64 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.489 ' OE1' ' N ' ' A' ' 133' ' ' ASN . 13.4 mm100 -69.83 -26.89 64.45 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.816 0.817 . . . . 13.82 108.987 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.15 -39.48 86.51 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.055 -1.028 . . . . 15.06 109.688 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -73.46 -48.95 29.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.264 -0.897 . . . . 14.68 112.471 -178.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.688 HG21 HG22 ' A' ' 132' ' ' THR . 7.4 m -60.85 -38.51 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 120.213 -1.555 . . . . 11.69 110.506 -178.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' N ' HG23 ' A' ' 10' ' ' VAL . 9.6 mtmp? -58.99 -33.82 71.13 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.769 -1.207 . . . . 10.51 109.549 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.04 -36.94 78.37 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.581 -1.266 . . . . 10.82 107.581 179.364 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.553 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 42.5 m0 -58.91 -25.75 63.72 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.749 -0.834 . . . . 6.2599999999999998 108.749 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.41 -11.93 53.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.548 -1.345 . . . . 0.01 109.273 179.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.518 ' OE1' ' N ' ' A' ' 15' ' ' GLU . 0.4 OUTLIER -85.72 -33.67 21.42 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.127 -0.983 . . . . 0.01 110.632 -179.803 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.478 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 16.7 p -171.9 148.42 2.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.671 -1.268 . . . . 0.01 111.034 -179.411 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.537 HD23 ' CD2' ' A' ' 111' ' ' PHE . 59.0 tp -59.98 -40.07 87.88 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.904 -0.498 . . . . 0.01 110.107 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.9 -40.06 60.08 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.282 -0.886 . . . . 0.01 109.494 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.96 -41.52 95.39 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.216 -0.928 . . . . 0.01 110.999 -179.285 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.1 -48.61 81.02 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.009 -1.057 . . . . 0.01 109.591 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -78.99 -23.7 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.01 110.839 -179.193 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -86.98 -4.47 59.18 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.705 -1.247 . . . . 0.01 110.286 -178.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.565 ' CE1' ' H ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -94.3 133.09 38.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.01 108.598 179.644 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.496 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 87.1 tt0 -60.01 -37.84 80.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.071 -1.018 . . . . 0.01 109.402 -179.172 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.565 ' H ' ' CE1' ' A' ' 23' ' ' HIS . 16.0 t -81.41 -34.41 31.6 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.911 -1.118 . . . . 0.01 108.573 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.0 -44.54 97.12 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 107.644 -2.182 . . . . 0.01 107.644 178.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.98 -44.02 94.76 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.341 -1.093 . . . . 0.01 108.302 178.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.26 74.5 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.092 -1.005 . . . . 0.01 108.798 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 -39.26 76.6 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.343 -0.848 . . . . 0.01 109.105 179.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CE2' HD11 ' A' ' 34' ' ' LEU . 39.0 t80 -69.69 -40.02 76.6 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.335 -0.853 . . . . 0.0 110.268 -179.206 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -58.23 -44.21 88.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.698 -1.251 . . . . 0.01 108.503 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.03 -40.27 78.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.01 109.68 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.1 -39.94 87.89 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.277 -0.89 . . . . 0.01 109.016 179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD11 ' CE2' ' A' ' 30' ' ' PHE . 82.7 mt -60.0 -39.6 86.35 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.119 -0.988 . . . . 0.0 108.926 178.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -59.23 -36.41 75.39 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.168 -0.957 . . . . 0.01 108.69 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.8 m -62.26 -33.64 75.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.208 -0.932 . . . . 0.0 109.175 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.477 ' OE2' ' NH1' ' A' ' 121' ' ' ARG . 99.8 mt-10 -102.53 3.37 37.39 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.334 -0.853 . . . . 0.01 109.225 -179.465 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.3 m-85 55.83 29.75 14.58 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.565 0.698 . . . . 0.01 109.238 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.5 m -101.55 30.04 4.51 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -62.63 -28.27 69.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.302 -0.874 . . . . 0.0 109.431 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.616 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 1.5 pm0 -61.15 -29.57 69.87 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.574 -1.329 . . . . 0.0 108.98 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.52 -45.31 94.28 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.28 -0.888 . . . . 0.0 111.102 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.8 tp -69.96 -40.06 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.603 -1.31 . . . . 0.0 108.447 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -62.82 -40.77 98.41 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 65.0 t80 -62.18 -41.79 98.65 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 89.4 t90 -61.61 -39.96 93.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.684 -0.635 . . . . 0.01 109.644 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.89 -40.03 87.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.327 -0.858 . . . . 0.0 109.248 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.8 p -65.94 -37.39 85.91 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.886 -1.134 . . . . 0.0 108.246 178.884 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.591 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 72.9 m -64.47 -37.99 89.45 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.564 -0.71 . . . . 0.01 109.452 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 73.8 mm-40 -59.8 -43.9 94.24 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.893 -1.129 . . . . 0.01 108.845 179.807 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.42 -39.99 89.44 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.955 -1.498 . . . . 0.01 106.955 178.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.58 -40.72 96.04 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.121 -0.696 . . . . 0.01 109.121 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 68.0 mttm -61.61 -39.06 89.91 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.19 -0.944 . . . . 0.01 110.905 179.703 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -73.6 -39.96 64.21 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.99 -1.069 . . . . 0.01 109.568 -178.415 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 86.0 mt -70.9 100.08 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 O-C-N 121.022 -1.049 . . . . 0.01 108.656 178.501 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -95.16 0.4 54.11 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.135 -0.978 . . . . 0.01 109.465 -179.708 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.0 m -88.5 114.63 60.49 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 108.517 -0.92 . . . . 0.01 108.517 179.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -68.64 1.29 3.86 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 CA-C-N 120.254 1.126 . . . . 0.01 112.6 -179.198 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -85.23 -28.42 25.4 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.04 -1.038 . . . . 0.01 109.353 179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.9 mtmm -96.02 -20.26 18.83 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.195 -0.94 . . . . 0.01 110.546 -179.514 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 65' ' ' ALA . 85.7 mt -62.97 -39.94 96.2 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.922 -1.112 . . . . 0.01 109.278 -179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -51.51 -64.32 1.49 Allowed Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.324 -0.86 . . . . 0.01 111.201 -179.495 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 3.4 Cg_exo -48.19 -55.9 3.62 Favored 'Trans proline' 0 N--CA 1.493 1.482 0 CA-C-N 119.514 0.862 . . . . 0.01 112.903 -179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -31.34 66.89 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.767 -1.208 . . . . 0.01 109.633 -179.423 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 61' ' ' LEU . . . -60.01 -46.63 88.87 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.854 -1.154 . . . . 0.01 108.987 179.416 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.16 -44.31 97.52 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.408 -0.807 . . . . 0.01 109.015 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.268 -0.895 . . . . 0.01 109.115 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 91.8 mt -60.82 -43.46 95.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.618 -1.253 . . . . 0.01 107.618 178.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.721 ' CE2' HG21 ' A' ' 73' ' ' ILE . 54.1 t80 -60.06 -44.92 94.39 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 121.575 0.703 . . . . 0.01 109.604 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' O ' ' OG ' ' A' ' 74' ' ' SER . 98.4 m-20 -63.01 -40.05 96.61 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.226 -0.921 . . . . 0.01 110.833 -178.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.581 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.6 mt-10 -87.12 -48.41 8.09 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.684 -1.26 . . . . 0.0 111.863 -179.081 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.605 ' CD1' ' NZ ' ' A' ' 79' ' ' LYS . 71.7 m-85 -85.81 -34.0 21.22 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.99 -1.069 . . . . 0.0 113.814 -176.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.721 HG21 ' CE2' ' A' ' 69' ' ' TYR . 49.2 mm -100.59 -13.24 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.535 -1.353 . . . . 0.01 112.769 -176.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 70' ' ' ASN . 30.2 m -59.6 134.92 57.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.366 -1.459 . . . . 0.01 110.153 -178.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.445 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 3.4 m -59.7 -19.17 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.252 -1.018 . . . . 0.01 108.252 178.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -100.63 3.87 42.88 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.612 -0.884 . . . . 0.01 108.612 178.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.581 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -47.18 135.67 9.8 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.54 -0.725 . . . . 0.01 110.087 -179.64 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 72.3 p -71.9 -17.15 62.12 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.605 ' NZ ' ' CD1' ' A' ' 72' ' ' PHE . 14.5 pttp -130.33 64.73 1.53 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 121.393 0.616 . . . . 0.01 109.669 -179.569 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' OE2' ' O ' ' A' ' 75' ' ' VAL . 95.3 mt-10 -63.45 147.12 52.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.509 -0.744 . . . . 0.01 109.8 179.631 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 m -105.92 137.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.068 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 82' ' ' ASN . 44.5 p-10 -72.12 104.18 3.53 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.178 -0.952 . . . . 0.0 109.526 -178.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.538 HD12 ' NH1' ' A' ' 88' ' ' ARG . 55.9 mt -145.45 167.32 23.26 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.89 -0.782 . . . . 0.01 108.89 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.513 ' OD2' ' NZ ' ' A' ' 109' ' ' LYS . 85.4 m-20 -70.14 154.95 41.3 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.01 109.83 -179.388 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 60.4 p -69.37 -17.34 63.67 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.478 -0.764 . . . . 0.01 110.28 -179.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 87' ' ' THR . 31.5 p -80.89 -40.72 24.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.066 -1.021 . . . . 0.01 109.485 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.478 ' N ' ' SG ' ' A' ' 86' ' ' CYS . 94.2 m -60.13 -40.06 88.47 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.318 -0.864 . . . . 0.01 108.979 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.597 ' NH1' ' CD1' ' A' ' 73' ' ' ILE . 2.8 mmp_? -62.65 -49.89 73.35 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.506 -0.746 . . . . 0.01 109.413 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -42.81 95.12 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.947 -1.131 . . . . 0.01 107.947 179.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.17 -40.91 91.59 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.977 -0.749 . . . . 0.01 108.977 179.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 44.6 m -63.61 -41.94 98.25 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.095 -1.003 . . . . 0.01 109.084 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 93.9 p -60.22 -39.48 86.79 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.182 -0.949 . . . . 0.01 108.629 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -65.74 -30.65 71.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.607 -0.683 . . . . 0.01 109.447 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.478 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 9.2 m120 -59.07 -24.27 62.75 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.01 109.123 -179.447 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.498 ' CE ' ' CG ' ' A' ' 69' ' ' TYR . 54.6 mtt -59.93 -37.78 80.48 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.12 -0.987 . . . . 0.01 108.506 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.416 ' O ' ' OE2' ' A' ' 97' ' ' GLU . 91.9 mt -65.06 -37.2 86.8 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.373 -0.973 . . . . 0.01 108.373 179.314 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.416 ' OE2' ' O ' ' A' ' 96' ' ' LEU . 68.4 mm-40 -139.78 76.58 28.86 Favored Pre-proline 0 N--CA 1.493 1.694 0 N-CA-C 108.408 -0.96 . . . . 0.01 108.408 179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -65.83 125.79 14.86 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 C-N-CA 121.058 1.172 . . . . 0.01 111.953 -179.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -130.86 170.35 14.53 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.709 -0.849 . . . . 0.01 108.709 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 53' ' ' LYS . 10.7 tp -70.27 -17.8 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 O-C-N 121.349 -0.844 . . . . 0.01 108.825 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -90.31 2.89 55.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.01 109.744 -179.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.478 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 8.7 t -60.94 -56.11 25.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.351 -0.843 . . . . 0.01 111.143 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -92.95 -4.55 52.54 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.894 -1.129 . . . . 0.01 110.849 -178.423 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -69.03 -39.96 78.91 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.597 -1.315 . . . . 0.01 108.705 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -64.13 -36.47 84.13 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.633 -0.877 . . . . 0.01 108.633 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.41 -49.94 30.06 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.124 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.496 ' NE2' ' CD1' ' A' ' 46' ' ' TRP . 43.2 tt0 -59.95 -40.07 87.75 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -59.91 -43.33 94.94 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.986 -1.116 . . . . 0.01 107.986 179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.513 ' NZ ' ' OD2' ' A' ' 84' ' ' ASP . 16.5 tptm -65.96 -35.51 80.79 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.042 -1.096 . . . . 0.01 108.042 179.337 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 25.3 mm -65.5 -39.93 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.4 m-85 -59.58 -47.06 87.03 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.06 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.99 -40.04 95.48 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.331 -0.856 . . . . 0.01 108.924 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.423 ' C ' HD13 ' A' ' 113' ' ' LEU . 0.3 OUTLIER -61.24 -60.09 4.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.395 -0.816 . . . . 0.0 109.521 -179.482 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 118' ' ' SER . 4.9 ptm -66.78 -40.16 88.08 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.304 -0.873 . . . . 0.0 109.327 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 88.4 tt0 -61.63 -46.91 87.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.592 -1.317 . . . . 0.01 109.791 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -70.15 -36.28 74.63 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 120.484 -1.385 . . . . 0.01 111.216 -179.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -102.85 -40.38 6.57 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.135 -0.978 . . . . 0.0 112.334 -177.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.9 p -79.02 -50.34 11.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.397 -1.44 . . . . 0.01 111.705 -177.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.553 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -55.03 -49.58 71.19 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.762 -1.212 . . . . 0.01 110.841 -178.611 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -60.0 -41.28 91.75 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 107.625 -1.25 . . . . 0.01 107.625 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 125' ' ' SER . 58.0 mtp180 -70.87 -39.97 72.57 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.497 -0.752 . . . . 0.01 109.532 178.115 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.498 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.6 OUTLIER -59.39 -46.54 88.4 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.391 -0.966 . . . . 0.01 108.391 -179.102 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.96 -38.63 83.05 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.23 -0.919 . . . . 0.01 109.006 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 48.0 mttm -95.87 3.59 53.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.17 -0.956 . . . . 0.01 110.592 -179.546 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 121' ' ' ARG . 89.3 p -71.52 149.26 45.93 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.769 -1.207 . . . . 0.01 109.828 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.515 ' HG2' HH11 ' A' ' 126' ' ' ARG . 0.3 OUTLIER -62.99 -42.19 99.77 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.01 109.728 -179.842 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -60.09 -45.84 91.58 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.181 -0.949 . . . . 0.01 109.372 -179.583 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.899 ' CZ ' HG21 ' A' ' 132' ' ' THR . 83.5 t80 -60.04 -47.06 87.43 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.26 -0.9 . . . . 0.01 109.777 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.08 -51.32 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.641 -0.824 . . . . 0.01 109.777 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.424 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 91.2 m-20 -61.35 -41.29 96.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.981 -1.075 . . . . 3.77 109.135 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.93 -33.67 72.45 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.402 -0.962 . . . . 3.8700000000000001 108.402 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.899 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 63.9 p -98.03 67.06 1.89 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.325 -0.86 . . . . 4.6299999999999999 110.293 -179.341 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.489 ' N ' ' OE1' ' A' ' 7' ' ' GLN . 1.5 m120 . . . . . 0 C--N 1.299 -1.602 0 N-CA-C 107.165 -1.42 . . . . 6.4800000000000004 107.165 178.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.068 -0.716 . . . . 18.699999999999999 109.068 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.8 p -73.11 161.02 31.11 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.108 -0.995 . . . . 15.970000000000001 109.61 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.85 -29.25 67.52 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.416 -0.802 . . . . 13.82 109.546 -179.814 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -64.38 -38.91 92.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.155 -0.966 . . . . 15.06 110.939 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.491 ' CD ' ' NE2' ' A' ' 23' ' ' HIS . 98.8 mt-10 -69.83 -46.52 65.46 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.876 -1.14 . . . . 14.68 110.975 -177.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 m -60.08 -39.13 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 120.737 -1.227 . . . . 11.69 109.356 179.548 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -59.75 -40.78 89.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.982 -1.074 . . . . 10.51 108.873 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.28 -39.92 95.93 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.597 -1.26 . . . . 10.82 107.597 179.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.471 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 34.2 m0 -59.9 -28.99 68.04 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.483 -0.932 . . . . 6.2599999999999998 108.483 179.252 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.22 -5.09 57.37 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.901 -1.124 . . . . 0.01 109.391 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.57 -29.39 14.91 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.252 -0.905 . . . . 0.01 110.374 -179.524 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 21.3 p -172.96 148.06 1.72 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.626 -1.296 . . . . 0.01 110.956 -179.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.776 HD23 ' CD2' ' A' ' 111' ' ' PHE . 63.8 tp -59.95 -39.87 87.04 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.678 -0.639 . . . . 0.01 110.256 179.42 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.539 ' O ' ' N ' ' A' ' 22' ' ' ASN . 99.2 mt-10 -52.49 -44.31 65.55 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.245 -0.909 . . . . 0.01 109.889 -178.736 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.15 -47.72 84.72 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.148 -0.97 . . . . 0.01 110.14 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.1 tp -59.97 -45.21 93.4 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.157 -0.964 . . . . 0.01 109.074 -179.788 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.4 mt -79.93 -24.39 11.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.421 -0.799 . . . . 0.01 110.551 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 18' ' ' GLU . 97.4 m-20 -90.64 -0.11 57.58 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.416 -1.427 . . . . 0.01 110.446 -179.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.491 ' NE2' ' CD ' ' A' ' 9' ' ' GLU . 60.6 t-80 -96.06 134.37 39.17 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.988 -1.07 . . . . 0.01 109.581 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -60.33 -39.91 88.76 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.362 -0.836 . . . . 0.01 111.15 -178.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -84.17 -33.42 24.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.01 108.425 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.89 -42.94 98.42 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 107.469 -2.252 . . . . 0.01 107.469 178.229 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.0 -50.14 74.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.432 -1.04 . . . . 0.01 109.163 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.8 93.29 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.771 -1.206 . . . . 0.01 108.076 179.628 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.0 -40.37 75.3 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.642 -0.661 . . . . 0.01 109.414 179.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.525 ' N ' ' O ' ' A' ' 26' ' ' GLY . 31.8 t80 -70.08 -43.0 72.03 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.327 -0.858 . . . . 0.0 110.601 -178.728 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -59.96 -41.11 91.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.84 -1.162 . . . . 0.01 109.613 -179.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.28 82.1 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.788 -1.19 . . . . 0.01 107.788 178.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -61.11 -40.09 92.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.739 -0.601 . . . . 0.01 110.342 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.503 HD21 ' CE2' ' A' ' 30' ' ' PHE . 88.5 mt -60.47 -39.73 88.68 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 -179.578 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 ttmp? -57.88 -39.76 78.6 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.2 m -62.54 -28.95 70.21 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -102.67 4.24 37.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.481 -0.762 . . . . 0.01 109.16 179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.433 ' N ' ' O ' ' A' ' 34' ' ' LEU . 90.6 m-85 53.76 28.74 8.58 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.471 -0.768 . . . . 0.01 109.498 -179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 m -106.84 26.1 10.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 4.3 pm0 -64.41 -22.77 67.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.284 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.4 pt-20 -62.11 -32.32 72.88 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.725 -1.235 . . . . 0.0 108.344 179.011 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.06 -44.91 94.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.644 -0.66 . . . . 0.0 111.406 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 43' ' ' ILE . 8.6 tp -70.02 -42.14 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 120.588 -1.32 . . . . 0.0 109.23 -178.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.16 -45.51 92.83 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 178.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.581 ' CE2' ' SG ' ' A' ' 49' ' ' CYS . 69.2 t80 -61.98 -47.04 86.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.802 ' HE1' HE21 ' A' ' 107' ' ' GLN . 82.7 t90 -60.14 -41.71 93.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.411 -0.805 . . . . 0.01 109.558 179.781 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.44 -40.98 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 120.996 -1.065 . . . . 0.0 108.809 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 80.6 p -66.7 -37.73 85.31 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.112 -0.992 . . . . 0.0 108.418 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.581 ' SG ' ' CE2' ' A' ' 45' ' ' PHE . 87.2 m -66.81 -36.84 83.3 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.342 -0.849 . . . . 0.01 109.372 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.517 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 70.3 mm-40 -60.17 -46.58 89.23 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.836 -1.165 . . . . 0.01 109.396 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -60.18 -40.02 88.54 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.229 -1.026 . . . . 0.01 108.229 179.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.461 ' CZ ' HD13 ' A' ' 61' ' ' LEU . 32.3 t80 -60.71 -39.95 90.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.336 -0.987 . . . . 0.01 108.336 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -71.95 -20.71 61.71 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.689 -0.632 . . . . 0.01 111.353 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -83.01 -28.88 29.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.743 -1.223 . . . . 0.01 109.286 -178.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 95.4 mt -73.5 121.5 24.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.235 -0.915 . . . . 0.01 109.072 179.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -98.46 -0.13 44.07 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.091 -1.006 . . . . 0.01 109.053 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m -95.98 111.14 55.21 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.436 -0.79 . . . . 0.01 109.163 179.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -71.15 0.08 7.23 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 CA-C-N 120.163 1.094 . . . . 0.01 111.863 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 92.9 p -86.45 -26.62 24.59 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.198 -0.939 . . . . 0.01 109.898 -179.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -91.73 -17.61 25.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.15 -0.969 . . . . 0.01 109.761 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 52' ' ' TYR . 86.1 mt -62.03 -40.17 94.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.938 . . . . 0.01 109.881 -179.826 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.436 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.1 OUTLIER -50.07 -63.45 1.78 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.159 -0.963 . . . . 0.01 110.982 -179.091 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.4 Cg_exo -43.44 -62.52 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 120.744 0.963 . . . . 0.01 113.036 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.43 ' HB2' ' HZ2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -72.85 -21.07 61.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.005 -1.06 . . . . 0.01 110.832 -178.692 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 61' ' ' LEU . . . -59.29 -44.74 92.47 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.658 -1.276 . . . . 0.01 107.859 179.324 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.96 -43.87 98.12 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.619 -0.882 . . . . 0.01 108.619 178.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.25 -48.22 82.44 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.385 -0.822 . . . . 0.01 109.705 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 85.4 mt -67.74 -47.89 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.22 -0.925 . . . . 0.01 109.479 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' HG21 ' A' ' 73' ' ' ILE . 48.5 t80 -60.3 -50.03 75.24 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.532 0.682 . . . . 0.01 110.027 -179.827 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' ' 74' ' ' SER . 91.8 m-20 -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.66 -0.65 . . . . 0.01 110.344 -178.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -73.91 -27.99 61.31 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 121.473 -0.767 . . . . 0.0 112.469 -177.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -130.57 -21.44 2.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.596 -1.315 . . . . 0.0 113.45 -177.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.47 HG21 ' CE2' ' A' ' 69' ' ' TYR . 47.3 mm -103.96 -34.6 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 120.412 -1.43 . . . . 0.01 112.118 -177.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.452 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 16.7 p -59.41 131.61 51.48 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.455 -1.403 . . . . 0.01 109.414 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.9 m -55.24 -10.0 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.473 -0.767 . . . . 0.01 108.988 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.435 ' N ' ' C ' ' A' ' 74' ' ' SER . 97.9 mt-30 -96.56 -2.0 45.89 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.425 -0.797 . . . . 0.01 109.323 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.0 141.31 22.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.346 -0.846 . . . . 0.01 109.459 179.869 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.0 p -70.07 -19.95 63.24 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.01 109.522 179.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.5 pttm -137.48 88.07 2.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.405 -0.809 . . . . 0.01 109.024 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.452 ' OE2' ' O ' ' A' ' 74' ' ' SER . 63.8 mm-40 -64.08 153.34 37.85 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.652 0.739 . . . . 0.01 110.08 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.7 m -114.4 147.77 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.6 109.76 8.34 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.09 -1.006 . . . . 0.0 109.43 -179.589 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.9 mt -144.43 164.63 30.27 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.644 -0.873 . . . . 0.01 108.644 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 85' ' ' SER . 46.0 t0 -69.99 159.79 33.14 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.177 -0.952 . . . . 0.01 109.047 -179.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.517 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 74.3 m -67.51 -32.59 73.49 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.305 -0.872 . . . . 0.01 110.126 -179.253 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 57.9 m -81.04 -31.47 34.51 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.01 -1.056 . . . . 0.01 109.631 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.5 ' OG1' ' NZ ' ' A' ' 109' ' ' LYS . 97.0 m -60.12 -47.81 84.37 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.156 -0.965 . . . . 0.01 109.418 179.329 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.468 ' NH2' ' O ' ' A' ' 73' ' ' ILE . 60.7 mtp180 -61.22 -44.4 97.33 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.496 -0.927 . . . . 0.01 108.496 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.16 -39.97 88.26 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 121.593 0.711 . . . . 0.01 109.171 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.511 ' OE1' ' NH2' ' A' ' 93' ' ' ARG . 45.5 tp10 -58.69 -47.04 85.85 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.352 -0.842 . . . . 0.01 109.598 -179.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 m -62.06 -39.91 93.97 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.967 -1.083 . . . . 0.01 108.908 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.7 p -60.2 -41.1 92.25 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.597 -0.689 . . . . 0.01 109.78 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.511 ' NH2' ' OE1' ' A' ' 90' ' ' GLU . 83.9 mtm180 -69.0 -33.86 74.35 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.01 109.926 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -67.22 -19.97 65.62 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.237 -0.914 . . . . 0.01 110.575 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.3 mtp -60.0 -39.97 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.854 -1.154 . . . . 0.01 109.341 -179.586 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.663 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.9 mp -67.02 -31.61 72.27 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.269 -1.012 . . . . 0.01 108.269 179.237 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 99' ' ' THR . 42.2 mt-10 -140.29 77.1 25.05 Favored Pre-proline 0 N--CA 1.492 1.642 0 N-CA-C 108.231 -1.026 . . . . 0.01 108.231 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.25 130.87 41.63 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.308 1.339 . . . . 0.01 112.489 -178.906 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.418 HG23 ' O ' ' A' ' 97' ' ' GLU . 26.9 p -130.25 166.8 19.57 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.867 -0.79 . . . . 0.01 108.867 179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.1 tp -72.0 -19.14 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.399 -0.813 . . . . 0.01 108.986 179.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.8 p -92.66 5.85 49.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.259 -0.9 . . . . 0.01 109.229 179.728 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.49 -57.88 11.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.566 -0.709 . . . . 0.01 110.751 -179.234 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -94.97 -3.53 48.34 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.053 -1.029 . . . . 0.01 111.295 -178.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -61.84 -39.89 93.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.6 -1.313 . . . . 0.01 109.145 179.171 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.21 -36.95 78.84 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.712 -0.847 . . . . 0.01 108.712 -179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.64 90.87 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.414 -0.804 . . . . 0.0 109.337 -179.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.802 HE21 ' HE1' ' A' ' 46' ' ' TRP . 56.2 tt0 -60.05 -44.0 94.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.871 -1.143 . . . . 0.0 108.59 179.755 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -60.07 -42.02 93.67 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.382 -0.823 . . . . 0.01 108.967 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.5 ' NZ ' ' OG1' ' A' ' 87' ' ' THR . 29.9 mmtp -68.44 -40.04 81.27 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.28 -0.887 . . . . 0.01 109.248 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 37.8 mm -70.08 -45.57 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.829 -1.17 . . . . 0.0 108.826 178.918 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.776 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.7 m-85 -60.11 -49.45 77.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.997 -1.064 . . . . 0.0 108.617 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -67.09 -43.63 82.08 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.936 -1.103 . . . . 0.01 109.981 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.0 -53.93 51.2 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.965 . . . . 0.0 110.826 -178.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.583 ' SD ' HD21 ' A' ' 17' ' ' LEU . 12.4 ptm -64.91 -38.08 89.77 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.14 -0.975 . . . . 0.0 109.811 -179.101 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.506 ' HG3' HD22 ' A' ' 17' ' ' LEU . 84.3 mt-10 -61.19 -40.22 93.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.779 -1.2 . . . . 0.01 109.961 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -70.03 -39.77 75.57 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 120.814 -1.179 . . . . 0.01 110.964 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -101.04 -37.98 8.38 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.032 -1.042 . . . . 0.0 111.796 -178.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 114' ' ' MET . 20.9 p -79.66 -55.54 4.94 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.208 -1.558 . . . . 0.01 112.053 -177.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.471 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -52.9 -50.44 63.89 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.75 -1.219 . . . . 0.01 110.917 -178.121 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.508 ' HG2' HH11 ' A' ' 120' ' ' ARG . 17.7 mtt-85 -59.78 -42.24 92.92 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 118.993 -1.083 . . . . 0.01 108.388 -179.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.2 mtt180 -70.71 -39.92 73.15 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.241 -0.912 . . . . 0.01 108.888 178.022 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -57.62 -50.49 72.96 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.331 -0.856 . . . . 0.01 108.977 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.99 -38.93 84.02 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.813 -0.81 . . . . 0.01 108.813 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -87.58 -3.77 58.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.406 -0.809 . . . . 0.01 109.787 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 121' ' ' ARG . 91.0 p -70.28 157.21 38.12 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.004 -1.06 . . . . 0.01 109.797 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.468 ' NH1' ' CB ' ' A' ' 126' ' ' ARG . 11.3 mtp-105 -62.61 -40.75 97.95 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.434 -0.791 . . . . 0.01 110.745 -179.603 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.11 -49.98 75.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.1 -1.0 . . . . 0.01 110.525 -178.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.557 ' CD1' ' OG1' ' A' ' 132' ' ' THR . 40.1 t80 -66.18 -42.84 88.33 Favored 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.249 -0.907 . . . . 0.01 109.736 -179.219 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.7 mt -60.2 -50.42 73.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.432 -0.792 . . . . 0.01 110.576 -179.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.893 -1.129 . . . . 3.77 109.127 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 74.1 mt -69.77 -40.04 76.31 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.968 -1.123 . . . . 3.8700000000000001 107.968 178.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.557 ' OG1' ' CD1' ' A' ' 128' ' ' TYR . 71.2 p -117.57 95.29 4.88 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.64 -1.615 . . . . 4.6299999999999999 106.64 177.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 . . . . . 0 C--N 1.289 -2.059 0 C-N-CA 119.894 -0.722 . . . . 6.4800000000000004 109.48 -178.202 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 35.5 t . . . . . 0 N--CA 1.498 1.945 0 CA-C-O 121.11 0.481 . . . . 18.699999999999999 109.841 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 99.5 p -76.31 158.65 31.3 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 15.970000000000001 108.815 179.267 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -74.08 -15.37 61.06 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.182 -0.949 . . . . 13.82 109.278 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -69.62 -37.81 76.98 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.987 -1.071 . . . . 15.06 109.108 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 77.1 mm-40 -75.18 -42.46 55.79 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 14.68 112.363 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.608 HG21 HG22 ' A' ' 132' ' ' THR . 10.3 m -60.0 -38.34 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 120.625 -1.297 . . . . 11.69 110.135 -178.171 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -60.13 -30.24 69.16 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.095 -1.003 . . . . 10.51 109.191 179.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -59.96 -40.02 87.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.943 -1.503 . . . . 10.82 106.943 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 30.2 m0 -59.84 -31.98 70.25 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.929 -0.767 . . . . 6.2599999999999998 108.929 179.34 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.96 -9.47 59.83 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.421 -1.424 . . . . 0.01 109.741 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.77 -33.21 17.53 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.052 -1.03 . . . . 0.01 111.139 -179.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.523 ' OG ' ' ND2' ' A' ' 19' ' ' ASN . 65.6 p -171.3 147.2 2.44 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.695 -1.253 . . . . 0.01 110.486 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.671 HD23 ' CD2' ' A' ' 111' ' ' PHE . 57.5 tp -59.16 -39.97 84.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.867 -0.521 . . . . 0.01 110.373 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -54.69 -39.9 68.58 Favored 'General case' 0 C--N 1.296 -1.752 0 O-C-N 121.201 -0.937 . . . . 0.01 109.374 -179.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' ND2' ' OG ' ' A' ' 16' ' ' SER . 97.9 m-20 -62.76 -40.8 98.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.01 110.917 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.98 -47.08 87.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.065 -1.022 . . . . 0.01 109.953 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.8 pt -80.31 -15.08 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.956 -1.09 . . . . 0.01 110.627 -179.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -89.16 -10.89 45.51 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.588 -1.32 . . . . 0.01 110.236 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 31.6 t-80 -90.3 138.91 31.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.869 -1.144 . . . . 0.01 108.921 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -60.06 -39.73 87.01 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.574 -0.704 . . . . 0.01 109.674 -179.12 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 7.4 t -83.66 -24.47 31.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.921 -1.112 . . . . 0.01 108.54 179.69 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.32 -46.98 74.56 Favored Glycine 0 N--CA 1.485 1.918 0 N-CA-C 107.462 -2.255 . . . . 0.01 107.462 178.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.08 -45.01 94.31 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.766 -1.198 . . . . 0.01 107.766 178.223 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.91 -50.36 74.07 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.306 -0.871 . . . . 0.01 109.175 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.04 80.41 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.463 -0.773 . . . . 0.01 109.293 179.738 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.664 ' CE2' HD11 ' A' ' 34' ' ' LEU . 50.7 t80 -61.86 -45.5 93.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.43 -0.794 . . . . 0.0 110.251 -179.54 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -60.0 -39.95 87.53 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.206 -0.934 . . . . 0.01 109.271 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.68 77.91 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.9 -1.125 . . . . 0.01 109.315 179.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -59.94 -42.33 93.77 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.971 -1.08 . . . . 0.01 109.823 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 ' CE2' ' A' ' 30' ' ' PHE . 98.0 mt -60.1 -39.57 86.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.11 -0.994 . . . . 0.0 108.401 179.521 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -59.98 -37.72 80.48 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.626 -0.879 . . . . 0.01 108.626 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 56.8 m -60.1 -37.96 81.52 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.331 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -100.57 4.81 43.74 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.011 -0.736 . . . . 0.01 109.011 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 89.9 m-85 53.02 35.84 20.54 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.569 -0.707 . . . . 0.01 110.111 179.081 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 42.1 1.15 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -67.49 -16.95 64.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.454 -0.779 . . . . 0.0 109.624 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.43 -39.21 89.95 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 120.753 -1.217 . . . . 0.0 108.556 179.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.628 HD21 HD21 ' A' ' 82' ' ' ASN . 98.6 m-20 -60.19 -49.94 75.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.506 -0.746 . . . . 0.0 110.868 -179.722 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 9.6 tp -70.2 -41.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 120.785 -1.197 . . . . 0.0 110.022 -179.185 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -61.33 -44.34 97.36 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.008 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -65.25 -42.8 92.96 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.448 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 79.1 t90 -59.95 -44.64 94.26 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.01 109.413 179.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.9 mt -59.98 -48.17 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.107 -0.996 . . . . 0.0 108.746 -179.551 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 96.4 p -66.54 -36.81 83.58 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.53 -39.31 88.55 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.439 -0.788 . . . . 0.01 109.464 179.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 61.0 mm-40 -59.87 -42.58 94.0 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.909 -1.12 . . . . 0.01 109.319 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -60.06 -39.99 87.94 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.356 -1.35 . . . . 0.01 107.356 178.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -63.79 -39.98 95.55 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.753 -0.832 . . . . 0.01 108.753 178.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.626 ' NZ ' ' NE2' ' A' ' 107' ' ' GLN . 17.2 mttp -71.48 -20.23 62.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.623 -0.673 . . . . 0.01 110.734 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -88.7 -26.98 21.53 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.709 -1.244 . . . . 0.01 109.63 -179.409 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.538 ' O ' HD13 ' A' ' 100' ' ' ILE . 95.2 mt -74.48 114.95 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.008 -1.057 . . . . 0.01 108.421 178.891 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -94.53 1.03 55.69 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.121 -0.987 . . . . 0.01 109.904 -179.003 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.8 m -93.17 112.56 56.8 Favored Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.192 -0.942 . . . . 0.01 109.36 179.755 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -70.49 -0.53 7.65 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.169 1.096 . . . . 0.01 112.127 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 p -87.45 -28.76 21.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.14 -0.975 . . . . 0.01 109.824 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -92.88 -13.73 28.58 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.104 -0.998 . . . . 0.01 110.696 -179.308 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.4 mt -60.42 -39.82 88.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.699 -1.25 . . . . 0.01 109.717 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.442 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.45 -64.36 1.34 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.338 -0.851 . . . . 0.01 111.16 -179.515 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 7.8 Cg_exo -42.09 -57.08 1.68 Allowed 'Trans proline' 0 N--CA 1.489 1.234 0 C-N-CA 120.881 1.054 . . . . 0.01 113.271 -179.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -29.64 65.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.805 -1.184 . . . . 0.01 109.953 -179.358 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.45 -47.11 86.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.82 -1.175 . . . . 0.01 108.474 179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -60.18 -42.37 94.88 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.93 . . . . 0.01 108.851 179.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -65.81 -46.95 76.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.596 -0.69 . . . . 0.01 109.457 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.12 -45.51 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.01 109.452 179.703 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 73' ' ' ILE . 65.0 t80 -60.49 -49.97 75.43 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.387 -0.82 . . . . 0.01 110.169 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -62.14 -40.07 94.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.796 . . . . 0.01 110.035 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -79.6 -56.51 4.25 Favored 'General case' 0 C--N 1.298 -1.633 0 O-C-N 120.955 -1.091 . . . . 0.0 111.882 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -87.19 -34.27 19.07 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -176.594 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 73' ' ' ILE . 50.8 mm -96.2 -13.68 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 120.223 -1.548 . . . . 0.01 112.184 -177.007 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.3 p -60.01 131.64 51.48 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.373 -1.454 . . . . 0.01 109.084 179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.0 m -59.44 -14.44 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.064 -1.022 . . . . 0.01 108.674 179.629 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -100.04 1.64 42.6 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 108.961 -0.755 . . . . 0.01 108.961 179.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.9 141.29 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.458 -0.776 . . . . 0.01 109.725 -179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 27.1 p -69.72 -23.24 63.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.029 -1.044 . . . . 0.01 108.363 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.8 pttm -134.93 81.58 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.694 -0.854 . . . . 0.01 108.694 179.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -60.97 143.58 54.92 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.116 -0.99 . . . . 0.01 110.068 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.7 m -91.88 143.24 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.628 HD21 HD21 ' A' ' 42' ' ' ASN . 7.3 p30 -71.11 97.07 1.43 Allowed 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.055 -179.311 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 94.5 mt -140.92 157.38 45.43 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.936 -0.764 . . . . 0.01 108.936 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.431 ' CG ' ' NZ ' ' A' ' 109' ' ' LYS . 41.8 p-10 -74.18 169.94 16.54 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.188 -0.945 . . . . 0.01 109.545 -179.741 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 m -70.08 -19.05 63.29 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.442 -0.786 . . . . 0.01 110.187 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 35.6 t -81.96 -44.08 17.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.006 -1.059 . . . . 0.01 110.037 -179.326 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.406 ' OG1' ' OD1' ' A' ' 84' ' ' ASP . 94.6 m -60.47 -47.17 87.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.98 -1.075 . . . . 0.01 109.496 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -60.15 -50.46 73.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.268 -0.895 . . . . 0.01 109.095 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -62.27 -39.8 94.12 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 108.623 -0.88 . . . . 0.01 108.623 179.096 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' OE2' ' OE1' ' A' ' 105' ' ' GLU . 84.6 tt0 -59.96 -41.66 92.42 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.289 -0.882 . . . . 0.01 109.66 -179.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.6 m -63.0 -40.8 98.86 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.977 -1.077 . . . . 0.01 108.168 179.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 77.4 p -62.17 -42.26 99.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.493 -0.755 . . . . 0.01 109.465 179.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 64.3 mtm-85 -68.62 -34.01 75.03 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.01 109.185 179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 11.0 m120 -64.32 -15.76 60.9 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.368 -0.832 . . . . 0.01 109.264 -179.73 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmt -59.93 -36.79 77.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.407 -0.808 . . . . 0.01 108.885 179.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.673 ' N ' HD12 ' A' ' 96' ' ' LEU . 7.4 mp -68.38 -32.41 72.46 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.384 -0.969 . . . . 0.01 108.384 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -140.09 74.25 31.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 N-CA-C 108.669 -0.863 . . . . 0.01 108.669 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -66.02 132.14 29.19 Favored 'Trans proline' 0 N--CA 1.49 1.312 0 C-N-CA 121.375 1.383 . . . . 0.01 112.293 -179.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.4 p -129.99 169.23 15.52 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.94 -0.763 . . . . 0.01 108.94 179.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.538 HD13 ' O ' ' A' ' 55' ' ' ILE . 10.6 tp -72.04 -20.94 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.01 109.299 179.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -93.34 0.49 56.95 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.213 -0.929 . . . . 0.01 109.506 -179.755 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.507 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 11.2 t -60.79 -42.44 97.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.01 110.072 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -95.01 -12.84 25.93 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.113 -0.992 . . . . 0.01 110.283 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.91 -39.88 86.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.808 -1.183 . . . . 0.01 108.574 179.504 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.435 ' OE1' ' OE2' ' A' ' 90' ' ' GLU . 86.6 tt0 -60.78 -37.85 83.29 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.265 -1.013 . . . . 0.01 108.265 179.358 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.03 -40.03 83.0 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.342 -0.849 . . . . 0.0 109.046 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' NZ ' ' A' ' 53' ' ' LYS . 52.5 tt0 -59.88 -40.05 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.913 -1.117 . . . . 0.0 108.038 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.5 -40.1 85.96 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.729 -0.841 . . . . 0.01 108.729 -179.668 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.431 ' NZ ' ' CG ' ' A' ' 84' ' ' ASP . 30.7 mmtp -66.66 -39.89 88.4 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.239 -0.913 . . . . 0.01 109.1 179.21 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.3 mm -69.93 -40.78 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 108.775 179.733 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.671 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -61.36 -48.96 78.88 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.143 -0.973 . . . . 0.0 108.597 178.896 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.8 -41.2 90.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.01 110.663 -179.299 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.462 ' CD2' ' ND2' ' A' ' 82' ' ' ASN . 57.8 tp -61.57 -59.54 5.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.876 -1.14 . . . . 0.0 109.897 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 118' ' ' SER . 2.3 ptm -68.9 -39.99 79.41 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.267 -0.896 . . . . 0.0 110.404 -179.359 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' A' ' 111' ' ' PHE . 85.9 tt0 -61.68 -44.53 96.78 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.937 -1.102 . . . . 0.01 109.985 -179.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.62 -12.5 59.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.836 -1.165 . . . . 0.01 110.837 -179.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.508 ' OD1' ' NE ' ' A' ' 121' ' ' ARG . 55.2 t0 -124.14 -59.01 1.52 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.19 -0.944 . . . . 0.0 111.302 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.529 ' O ' ' N ' ' A' ' 122' ' ' PHE . 29.0 p -60.02 -44.46 94.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.034 -1.041 . . . . 0.01 111.293 -177.994 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.552 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -57.68 -50.43 73.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.085 -1.01 . . . . 0.01 110.451 -178.638 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.1 mtp-105 -60.18 -40.53 90.31 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 120.705 -1.247 . . . . 0.01 107.793 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.608 ' O ' ' N ' ' A' ' 125' ' ' SER . 44.2 mtt-85 -69.89 -37.93 76.17 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.517 -0.739 . . . . 0.01 109.336 178.109 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -58.5 -48.26 81.42 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.235 -0.916 . . . . 0.01 109.084 -179.087 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.02 -39.94 87.58 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.169 -0.957 . . . . 0.01 108.718 179.652 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.5 4.93 53.18 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.529 -0.732 . . . . 0.01 109.864 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.608 ' N ' ' O ' ' A' ' 121' ' ' ARG . 23.0 m -72.26 157.21 38.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.997 -1.065 . . . . 0.01 110.227 -179.092 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.4 ' CA ' ' HE ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -68.33 -40.15 81.71 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.682 -0.636 . . . . 0.01 109.679 -179.895 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -61.04 -48.91 79.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.361 -0.837 . . . . 0.01 109.83 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 132' ' ' THR . 57.7 t80 -60.24 -49.61 76.94 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.369 -0.832 . . . . 0.01 109.513 -179.893 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.419 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 87.5 mt -62.31 -41.72 98.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.906 . . . . 0.01 110.228 -179.506 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -59.81 -48.6 81.04 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.756 -1.215 . . . . 3.77 108.041 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.05 -39.69 75.57 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.298 -1.001 . . . . 3.8700000000000001 108.298 178.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.608 HG22 HG21 ' A' ' 10' ' ' VAL . 18.8 p -112.4 69.92 0.7 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.82 -0.55 . . . . 4.6299999999999999 109.685 -179.391 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 129' ' ' LEU . 12.8 m120 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 120.949 -1.094 . . . . 6.4800000000000004 108.539 179.814 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.389 0.614 . . . . 18.699999999999999 109.696 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.1 p -77.09 161.16 28.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 15.970000000000001 109.358 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.96 -24.41 63.34 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.161 -0.962 . . . . 13.82 109.579 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.59 -40.03 80.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.191 -0.943 . . . . 15.06 110.893 -179.297 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.451 ' OE1' ' CD2' ' A' ' 23' ' ' HIS . 76.2 mm-40 -72.35 -44.18 62.99 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.949 -1.094 . . . . 14.68 111.197 -178.219 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG21 HG22 ' A' ' 132' ' ' THR . 19.1 m -59.79 -37.36 71.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.663 -1.273 . . . . 11.69 108.791 -179.94 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 18.1 mmtp -59.95 -35.25 74.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.302 -0.874 . . . . 10.51 108.922 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HB3' ' HZ3' ' A' ' 12' ' ' LYS . 9.2 mtpm? -61.34 -40.14 93.15 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 107.225 -1.398 . . . . 10.82 107.225 178.986 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 23' ' ' HIS . 33.6 m0 -57.8 -18.85 24.34 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 107.597 -1.261 . . . . 6.2599999999999998 107.597 178.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 11' ' ' LYS . . . -83.44 -9.73 58.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.346 -0.846 . . . . 0.01 108.752 179.446 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -85.86 -40.09 16.34 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.484 -0.76 . . . . 0.01 110.47 -179.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.437 ' C ' ' OH ' ' A' ' 119' ' ' TYR . 50.6 p -171.34 160.3 6.06 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.818 -1.176 . . . . 0.01 110.285 -179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.629 HD23 ' CD2' ' A' ' 111' ' ' PHE . 16.3 tp -59.93 -39.43 85.48 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.643 0.735 . . . . 0.01 109.133 -179.512 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 22' ' ' ASN . 95.2 mt-10 -52.94 -39.95 63.26 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.666 -0.646 . . . . 0.01 109.691 -179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -63.13 -46.6 86.48 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.893 -1.129 . . . . 0.01 109.217 179.601 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.96 -43.18 95.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.185 -0.947 . . . . 0.01 109.208 179.19 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.9 mt -79.14 -25.58 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.365 -0.834 . . . . 0.01 110.955 -179.293 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 18' ' ' GLU . 19.3 m120 -90.56 -3.18 57.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.815 -1.178 . . . . 0.01 111.851 -178.312 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CD2' ' OE1' ' A' ' 9' ' ' GLU . 41.1 t-80 -95.48 141.24 29.25 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.57 -1.331 . . . . 0.01 110.038 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -60.0 -40.21 88.43 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.508 -0.745 . . . . 0.01 109.996 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.3 t -84.25 -26.24 28.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.541 -1.349 . . . . 0.01 108.444 179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.02 -49.29 80.16 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 107.152 -2.379 . . . . 0.01 107.152 178.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.5 mt -59.89 -49.69 76.72 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.595 -0.944 . . . . 0.01 108.842 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.54 85.26 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.123 -0.985 . . . . 0.01 108.76 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.53 -44.18 78.98 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.422 -0.799 . . . . 0.01 109.016 179.214 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.682 ' CZ ' HD21 ' A' ' 34' ' ' LEU . 53.4 t80 -60.06 -48.36 82.03 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.338 -0.852 . . . . 0.0 109.775 -179.801 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -56.89 -40.04 75.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.01 108.633 179.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -44.11 88.17 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 107.56 -1.274 . . . . 0.01 107.56 177.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 65.2 t80 -59.91 -40.06 87.54 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.585 -0.697 . . . . 0.01 110.085 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.682 HD21 ' CZ ' ' A' ' 30' ' ' PHE . 90.7 mt -56.79 -37.67 71.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.938 -1.101 . . . . 0.0 108.695 -179.373 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -56.57 -37.53 70.7 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 119.409 -0.916 . . . . 0.01 108.725 179.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.9 m -61.66 -40.06 93.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.251 -0.906 . . . . 0.0 109.984 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' OE1' ' O ' ' A' ' 33' ' ' PHE . 31.6 mp0 -101.87 4.51 40.3 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.168 -0.957 . . . . 0.01 109.486 -179.523 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 34' ' ' LEU . 55.1 m-85 54.22 33.55 18.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.217 -0.927 . . . . 0.01 109.392 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.455 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -103.19 33.31 3.35 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.792 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' HA ' HD13 ' A' ' 34' ' ' LEU . 19.6 pt-20 -68.55 -24.53 64.63 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.072 -1.017 . . . . 0.0 109.946 -179.593 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 18.2 pt-20 -63.88 -30.36 71.45 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.281 -1.512 . . . . 0.0 108.493 179.372 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.597 ' ND2' HD12 ' A' ' 110' ' ' ILE . 20.6 m120 -61.05 -43.83 98.3 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.471 -0.768 . . . . 0.0 111.053 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HA ' ' A' ' 43' ' ' ILE . 9.7 tp -70.02 -39.97 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 120.422 -1.424 . . . . 0.0 108.615 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -61.66 -43.42 98.89 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 178.293 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -62.69 -40.24 96.51 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -59.95 -40.22 88.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.67 -0.644 . . . . 0.01 109.746 179.732 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.03 -40.56 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 108.667 -179.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 92.0 p -66.96 -39.95 87.38 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.237 -0.915 . . . . 0.0 108.738 179.439 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.9 t -67.13 -42.41 84.5 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.249 -0.907 . . . . 0.01 109.664 179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -59.91 -47.51 85.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.927 -1.108 . . . . 0.01 108.755 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.22 -39.96 88.47 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.632 -1.247 . . . . 0.01 107.632 178.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.07 -39.88 93.92 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.995 -0.743 . . . . 0.01 108.995 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HZ3' ' CG ' ' A' ' 104' ' ' ASP . 58.5 mttm -69.46 -22.69 63.62 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.361 -0.837 . . . . 0.01 111.074 -179.658 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -85.65 -30.35 23.3 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.917 -1.115 . . . . 0.01 109.11 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.401 HD12 ' HZ2' ' A' ' 64' ' ' LYS . 96.9 mt -76.37 111.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.289 -0.882 . . . . 0.01 108.976 179.131 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -99.25 0.6 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.173 -0.954 . . . . 0.01 109.872 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 72.9 m -91.05 113.13 57.16 Favored Pre-proline 0 N--CA 1.496 1.853 0 O-C-N 121.292 -0.88 . . . . 0.01 109.081 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -65.28 -6.84 14.11 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 120.271 1.133 . . . . 0.01 112.757 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 82.9 p -84.35 -24.13 29.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.01 109.877 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -94.94 -20.17 19.61 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.103 -0.998 . . . . 0.01 110.064 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.63 -40.04 95.76 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.01 109.331 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.444 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.5 OUTLIER -50.31 -64.12 1.45 Allowed Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.01 111.187 -179.235 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 15.3 Cg_exo -40.9 -64.44 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.082 1.188 . . . . 0.01 113.878 -179.644 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HZ2' HD12 ' A' ' 55' ' ' ILE . 16.4 ptpt -70.37 -29.64 66.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.791 -1.193 . . . . 0.01 110.571 -178.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.57 -49.9 75.76 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.726 -1.234 . . . . 0.01 108.789 179.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.59 -41.78 95.39 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.123 -0.986 . . . . 0.01 108.819 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -66.81 -46.4 75.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.165 -0.959 . . . . 0.01 108.993 179.249 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 83.9 mt -64.89 -49.45 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.338 -0.851 . . . . 0.01 109.388 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.7 t80 -62.67 -44.39 96.38 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.314 -0.866 . . . . 0.01 109.895 179.982 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -64.19 -40.06 95.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.547 -0.721 . . . . 0.01 110.704 -178.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.552 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 98.8 mt-10 -85.57 -49.03 8.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.809 -1.182 . . . . 0.0 112.134 -178.315 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -88.24 -39.0 14.79 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.705 -1.247 . . . . 0.0 113.517 -177.323 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 73' ' ' ILE . 47.5 mm -95.86 -14.48 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 120.443 -1.411 . . . . 0.01 112.692 -176.658 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.5 t -60.14 132.56 54.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.278 -1.514 . . . . 0.01 109.971 -179.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' OE2' ' A' ' 80' ' ' GLU . 12.2 m -60.48 -18.77 17.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 N-CA-C 108.262 -1.014 . . . . 0.01 108.262 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -96.11 0.76 51.79 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.24 -1.022 . . . . 0.01 108.24 178.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -45.78 138.31 4.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.748 -0.595 . . . . 0.01 110.103 -179.619 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 31.0 p -70.08 -21.15 63.17 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.01 108.207 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.5 pttt -130.98 74.47 1.6 Allowed 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.638 -0.875 . . . . 0.01 108.638 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.0 mt-10 -60.37 139.64 57.56 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.161 -0.962 . . . . 0.01 109.044 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.467 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 5.0 m -102.01 149.54 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.371 -0.83 . . . . 0.0 109.4 -179.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 82' ' ' ASN . 4.4 p30 -73.66 109.52 7.24 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.385 -0.822 . . . . 0.0 109.39 -179.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 87.3 mt -146.36 163.1 36.65 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.396 -0.815 . . . . 0.01 108.996 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.26 159.51 34.49 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.233 -0.917 . . . . 0.01 109.365 179.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 89.9 p -67.26 -24.77 65.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.221 -0.924 . . . . 0.01 109.183 -179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.472 ' O ' ' N ' ' A' ' 90' ' ' GLU . 72.0 m -82.71 -37.5 24.66 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.555 -0.906 . . . . 0.01 108.555 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.0 m -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.807 -0.812 . . . . 0.01 108.807 179.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.467 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 98.9 mtt180 -61.8 -49.84 74.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.129 -0.982 . . . . 0.01 108.48 179.401 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -60.32 -39.86 88.51 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.683 -0.858 . . . . 0.01 108.683 178.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 86' ' ' CYS . 89.2 tt0 -59.05 -41.75 88.65 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.439 -0.788 . . . . 0.01 109.0 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.1 m -64.85 -38.85 92.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.081 -1.012 . . . . 0.01 109.074 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.5 p -60.06 -39.83 87.35 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.546 -0.721 . . . . 0.01 110.035 -179.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -69.99 -36.83 75.47 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.906 -1.121 . . . . 0.01 109.551 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.26 -20.36 66.01 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.465 -0.772 . . . . 0.01 110.565 -178.686 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 52.7 mmm -60.05 -34.95 74.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.888 -1.133 . . . . 0.01 109.195 -179.502 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.05 -40.0 96.39 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.858 . . . . 0.01 108.699 179.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -140.8 79.8 18.63 Favored Pre-proline 0 N--CA 1.493 1.704 0 N-CA-C 108.114 -1.069 . . . . 0.01 108.114 179.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -57.82 135.34 68.47 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 120.893 1.062 . . . . 0.01 112.437 -178.667 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.8 p -127.66 172.12 11.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.935 -0.765 . . . . 0.01 108.935 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.2 tp -71.89 -21.51 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.385 -0.822 . . . . 0.01 108.961 179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.0 p -93.78 5.95 49.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.434 -0.791 . . . . 0.01 109.919 -179.582 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.1 t -60.29 -60.74 3.33 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.187 -0.946 . . . . 0.01 111.044 -179.126 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -94.03 -4.47 49.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.934 -1.104 . . . . 0.01 111.272 -178.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.536 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 90.2 m-20 -61.9 -40.06 94.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.641 -1.287 . . . . 0.01 109.256 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.409 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 84.7 tt0 -65.08 -29.82 70.73 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.434 -0.791 . . . . 0.01 109.429 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.14 72.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.207 -0.933 . . . . 0.0 109.117 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -60.11 -40.18 88.78 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.202 -0.936 . . . . 0.0 109.442 179.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -60.2 -40.79 91.31 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.364 -0.976 . . . . 0.01 108.364 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -64.68 -40.19 94.97 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.381 -0.97 . . . . 0.01 108.381 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.597 HD12 ' ND2' ' A' ' 42' ' ' ASN . 40.1 mm -66.79 -44.3 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.033 -1.042 . . . . 0.0 108.346 178.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.629 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.9 m-85 -60.23 -49.94 75.64 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.615 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.26 -41.14 98.19 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.062 -1.024 . . . . 0.01 109.967 -179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 tt -62.76 -57.54 10.58 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.885 -1.135 . . . . 0.0 110.427 -179.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.595 ' O ' ' N ' ' A' ' 118' ' ' SER . 9.7 ptm -65.75 -39.66 91.3 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.211 -0.931 . . . . 0.0 109.845 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.439 ' HG3' HD22 ' A' ' 17' ' ' LEU . 90.8 mt-10 -60.06 -39.88 87.56 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.494 -1.379 . . . . 0.01 110.139 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -69.89 -39.71 76.11 Favored 'General case' 0 C--N 1.296 -1.748 0 O-C-N 120.511 -1.368 . . . . 0.01 110.829 -178.847 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -104.98 -39.68 6.17 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.179 -0.951 . . . . 0.0 111.869 -178.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 114' ' ' MET . 16.6 p -71.06 -48.9 50.06 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.703 -1.248 . . . . 0.01 111.581 -177.616 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.437 ' OH ' ' C ' ' A' ' 16' ' ' SER . 0.1 OUTLIER -55.93 -49.65 72.9 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.733 -1.229 . . . . 0.01 110.081 -178.717 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.619 ' NH2' ' NZ ' ' A' ' 124' ' ' LYS . 18.6 mmm180 -62.34 -40.46 96.47 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.793 -1.188 . . . . 0.01 107.793 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.564 ' O ' ' N ' ' A' ' 125' ' ' SER . 31.2 mmt180 -70.8 -40.18 72.66 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.174 -0.954 . . . . 0.01 110.016 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.404 ' O ' ' OG ' ' A' ' 125' ' ' SER . 0.7 OUTLIER -60.04 -54.68 43.16 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.087 -1.008 . . . . 0.01 110.686 -178.859 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.05 -35.27 74.77 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.023 -1.048 . . . . 0.01 108.856 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.619 ' NZ ' ' NH2' ' A' ' 120' ' ' ARG . 42.7 mmtm -92.1 -1.47 57.17 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.41 -0.806 . . . . 0.01 109.587 -179.861 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.564 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.3 p -70.06 150.79 46.22 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.92 -1.113 . . . . 0.01 109.795 -179.597 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.509 ' NH1' ' OD2' ' A' ' 130' ' ' ASP . 44.9 ttt-85 -60.96 -39.33 89.14 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.456 -0.778 . . . . 0.01 108.96 178.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -58.33 -54.64 44.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.01 109.961 -179.093 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.843 ' CZ ' HG21 ' A' ' 132' ' ' THR . 50.7 t80 -60.32 -46.78 88.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.122 -0.986 . . . . 0.01 110.36 -179.489 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.4 mt -59.98 -50.95 71.71 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.251 -0.906 . . . . 0.01 110.672 -178.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.509 ' OD2' ' NH1' ' A' ' 126' ' ' ARG . 95.4 m-20 -60.04 -43.12 95.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.871 -1.143 . . . . 3.77 109.083 179.669 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.02 -39.54 75.75 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.72 -0.844 . . . . 3.8700000000000001 108.72 179.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.843 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 11.5 p -110.56 72.93 0.8 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.287 0.565 . . . . 4.6299999999999999 110.332 -179.302 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.509 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 74.3 m-80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 107.182 -1.414 . . . . 6.4800000000000004 107.182 178.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.544 ' CG2' ' SG ' ' A' ' 25' ' ' CYS . 74.4 t . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 121.637 0.732 . . . . 18.699999999999999 109.922 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 94.9 p -78.14 152.47 32.75 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.852 -0.53 . . . . 15.970000000000001 109.629 179.654 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' GLN . 4.1 mp0 -69.72 -18.84 63.55 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 108.734 -0.839 . . . . 13.82 108.734 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.78 -39.81 79.99 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.094 -1.004 . . . . 15.06 109.704 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' OE2' ' CE1' ' A' ' 23' ' ' HIS . 45.8 mt-10 -75.65 -40.16 56.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.25 -0.906 . . . . 14.68 111.694 -178.479 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.617 HG21 HG22 ' A' ' 132' ' ' THR . 3.4 m -60.89 -38.9 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.387 -1.446 . . . . 11.69 109.324 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -60.17 -35.99 76.58 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.61 -1.306 . . . . 10.51 108.514 178.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 mtpm? -63.61 -32.65 74.19 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.308 -0.997 . . . . 10.82 108.308 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.566 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 44.4 m0 -57.1 -35.56 69.56 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.078 -1.082 . . . . 6.2599999999999998 108.078 179.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.42 -6.56 59.06 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.58 -1.325 . . . . 0.01 109.476 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -95.53 -27.74 15.21 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.106 -0.996 . . . . 0.01 111.057 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.474 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 59.6 p -170.01 140.57 2.03 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.642 -1.286 . . . . 0.01 111.393 -179.376 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.803 HD23 ' CD2' ' A' ' 111' ' ' PHE . 27.7 tp -59.97 -40.02 87.66 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 121.248 0.547 . . . . 0.01 110.131 179.304 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 22' ' ' ASN . 50.0 mt-10 -56.65 -39.69 74.15 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.376 -0.828 . . . . 0.01 109.937 -179.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.0 -46.24 90.12 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.058 -1.026 . . . . 0.01 109.534 179.643 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.9 tp -61.44 -41.43 97.18 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.057 -1.027 . . . . 0.01 109.183 179.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 95.5 mt -78.68 -24.71 13.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 121.247 -0.908 . . . . 0.01 110.238 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.459 HD22 ' N ' ' A' ' 22' ' ' ASN . 2.3 m120 -86.52 -6.62 58.85 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.978 -1.076 . . . . 0.01 110.275 -179.169 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OE2' ' A' ' 9' ' ' GLU . 0.7 OUTLIER -92.62 137.62 32.21 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.839 -1.163 . . . . 0.01 109.265 179.829 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' ' ND1' ' A' ' 23' ' ' HIS . 53.0 tp10 -59.88 -39.6 85.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.195 -0.941 . . . . 0.01 109.818 -179.388 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' SG ' ' CG2' ' A' ' 5' ' ' VAL . 19.2 t -82.05 -32.92 30.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.896 -1.128 . . . . 0.01 108.791 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' PHE . . . -59.79 -43.32 98.01 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.536 -2.226 . . . . 0.01 107.536 178.593 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.1 -49.51 77.35 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.291 -1.123 . . . . 0.01 108.372 178.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.99 75.39 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 109.078 -0.712 . . . . 0.01 109.078 179.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.4 74.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.385 -0.969 . . . . 0.01 108.385 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.734 ' CE2' HD11 ' A' ' 34' ' ' LEU . 70.3 t80 -60.31 -52.97 63.01 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.297 -0.877 . . . . 0.0 108.708 179.2 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.26 -43.22 96.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.01 109.457 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.04 -44.69 72.17 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.21 -0.932 . . . . 0.01 108.662 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -60.65 -41.86 95.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.278 -0.889 . . . . 0.01 109.594 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.734 HD11 ' CE2' ' A' ' 30' ' ' PHE . 29.9 mt -60.04 -33.59 72.25 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.284 -0.885 . . . . 0.0 109.052 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -52.31 -39.62 60.81 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.599 -1.26 . . . . 0.01 107.599 -179.448 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -62.86 -27.91 69.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.055 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' A' ' 34' ' ' LEU . 99.2 mt-10 -100.3 -2.03 34.74 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.637 -0.875 . . . . 0.01 108.637 179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.548 ' N ' ' O ' ' A' ' 34' ' ' LEU . 63.2 m-85 53.42 36.28 22.67 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.526 -0.734 . . . . 0.01 110.211 179.362 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.54 32.33 3.12 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.346 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -61.31 -24.8 66.68 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.21 -0.931 . . . . 0.0 109.384 -179.165 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 21.1 pt-20 -64.36 -35.84 82.19 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -60.21 -49.89 75.85 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.574 -0.704 . . . . 0.0 110.704 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 tp -70.22 -40.06 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.581 -1.325 . . . . 0.0 109.698 -179.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -61.69 -40.89 96.61 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 178.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.77 -39.81 94.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.454 ' CZ2' ' OE2' ' A' ' 50' ' ' GLU . 84.9 t90 -60.19 -41.02 92.06 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.854 -0.529 . . . . 0.01 109.885 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.443 ' O ' ' OE1' ' A' ' 51' ' ' GLU . 96.5 mt -62.01 -49.68 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.094 -1.004 . . . . 0.0 109.275 -179.802 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.8 p -64.6 -40.16 95.01 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.409 -0.807 . . . . 0.0 109.009 179.67 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 t -67.9 -32.74 73.43 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.244 -0.91 . . . . 0.01 109.592 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' OE2' ' CZ2' ' A' ' 46' ' ' TRP . 28.5 mm-40 -59.85 -45.84 91.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.105 -0.997 . . . . 0.01 108.981 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 47' ' ' ILE . 6.7 mp0 -60.36 -39.66 87.99 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.755 -1.202 . . . . 0.01 107.755 178.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -61.76 -38.42 87.95 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.799 -0.815 . . . . 0.01 108.799 178.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -70.0 -20.02 63.3 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.728 -0.608 . . . . 0.01 110.241 -179.383 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -94.09 -26.72 16.62 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.934 -1.104 . . . . 0.01 109.926 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.5 mt -74.22 116.98 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.027 -1.045 . . . . 0.01 109.118 179.338 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -99.49 -0.62 40.3 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.275 -0.891 . . . . 0.01 109.429 -179.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.8 m -92.92 114.17 61.87 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.316 -0.865 . . . . 0.01 109.011 179.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -68.82 -2.46 9.52 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 CA-C-N 120.204 1.108 . . . . 0.01 111.81 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 55.8 p -86.34 -27.65 24.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.01 109.812 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -92.38 -16.58 25.77 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.106 -0.996 . . . . 0.01 110.6 -179.297 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.22 -40.08 96.44 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.879 -1.138 . . . . 0.01 109.341 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -48.52 -64.17 1.24 Allowed Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.202 -0.936 . . . . 0.01 110.331 -179.075 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 16.8 Cg_exo -40.94 -58.72 0.94 Allowed 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 120.693 0.929 . . . . 0.01 112.861 179.575 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.53 -30.79 63.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.145 -0.972 . . . . 0.01 110.578 -179.093 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -50.14 74.74 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.671 -1.268 . . . . 0.01 109.171 -179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.11 -45.18 93.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.197 -0.939 . . . . 0.01 109.474 179.715 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -62.29 -48.37 80.2 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.263 -0.898 . . . . 0.01 109.443 -179.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.4 mt -69.41 -46.71 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.283 -0.885 . . . . 0.01 109.686 -179.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' HG21 ' A' ' 73' ' ' ILE . 65.2 t80 -60.16 -48.43 81.76 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.245 -0.909 . . . . 0.01 109.456 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -63.45 -39.98 95.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.307 -0.871 . . . . 0.01 110.272 -179.541 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -80.73 -55.21 4.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.645 -1.284 . . . . 0.0 111.802 -178.445 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -86.42 -37.53 18.26 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.91 -1.119 . . . . 0.0 114.013 -176.841 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 ' CE1' ' A' ' 69' ' ' TYR . 49.1 mm -95.27 -12.13 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 120.345 -1.472 . . . . 0.01 112.56 -176.554 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.4 p -59.77 134.14 56.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.291 -1.506 . . . . 0.01 109.2 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.462 ' H ' HG22 ' A' ' 75' ' ' VAL . 2.4 m -60.15 -14.64 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.144 -0.972 . . . . 0.01 108.908 179.563 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -99.46 0.54 42.75 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.399 -0.813 . . . . 0.01 109.298 179.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -49.63 138.87 13.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.26 -0.9 . . . . 0.01 109.836 -179.524 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.8 p -70.39 -20.05 62.97 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.361 -0.837 . . . . 0.01 109.067 179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -136.1 74.15 1.49 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.539 -0.725 . . . . 0.01 109.304 -179.356 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 98.9 mt-10 -60.35 139.98 57.37 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.407 -0.808 . . . . 0.01 108.907 179.569 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 81' ' ' VAL . 2.4 m -85.56 148.41 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.937 -1.102 . . . . 0.0 109.024 179.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' OD1' ' CD1' ' A' ' 110' ' ' ILE . 3.9 p30 -71.66 102.46 2.78 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.316 -0.865 . . . . 0.0 109.313 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.644 ' H ' HH22 ' A' ' 88' ' ' ARG . 88.1 mt -146.07 170.65 16.24 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.882 -0.784 . . . . 0.01 108.882 -179.715 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -70.02 159.97 32.82 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.082 -1.011 . . . . 0.01 108.708 179.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.1 m -69.57 -23.98 63.63 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.367 -0.833 . . . . 0.01 109.584 -179.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 81.0 m -85.27 -29.49 24.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.078 -1.014 . . . . 0.01 109.896 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -42.01 93.97 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.142 -0.974 . . . . 0.01 109.555 179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.644 HH22 ' H ' ' A' ' 83' ' ' LEU . 17.6 mtt-85 -60.98 -49.95 75.36 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.143 -0.973 . . . . 0.01 108.842 179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -60.11 -40.01 88.2 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.629 -0.669 . . . . 0.01 109.37 179.467 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 82.6 tt0 -60.16 -40.76 91.03 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.851 . . . . 0.01 109.279 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.5 m -63.12 -40.28 97.15 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.018 -1.104 . . . . 0.01 108.018 179.169 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.5 p -60.51 -40.0 89.82 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.828 -0.804 . . . . 0.01 108.828 179.443 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -66.28 -38.68 88.35 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.503 -0.748 . . . . 0.01 109.298 179.588 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.413 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 93.9 m-20 -63.34 -19.94 65.07 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.284 -0.885 . . . . 0.01 110.598 -179.238 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 23.0 mmm -59.8 -32.29 70.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.755 -1.216 . . . . 0.01 108.736 -179.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.66 -32.69 74.4 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.964 -1.125 . . . . 0.01 107.964 178.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -143.21 78.23 15.18 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.354 -0.98 . . . . 0.01 108.354 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -62.03 120.78 8.53 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 121.034 1.156 . . . . 0.01 112.022 -179.464 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 46.0 p -126.1 171.43 10.84 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 179.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.02 -20.09 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.504 -0.748 . . . . 0.01 109.29 179.922 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -91.79 3.14 55.8 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.369 -0.832 . . . . 0.01 109.165 179.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.419 ' SG ' ' CD1' ' A' ' 103' ' ' PHE . 6.1 t -63.82 -51.27 65.47 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.01 110.835 -179.66 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.419 ' CD1' ' SG ' ' A' ' 102' ' ' CYS . 43.7 m-85 -98.05 -1.78 41.74 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.903 -1.123 . . . . 0.01 110.975 -178.712 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -60.53 -39.91 89.6 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 118.899 -1.12 . . . . 0.01 108.938 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.425 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 86.0 tt0 -64.0 -34.71 78.62 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.453 -0.943 . . . . 0.01 108.453 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.37 -58.14 4.39 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.171 -0.956 . . . . 0.0 109.11 179.767 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -59.91 -43.26 94.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.138 -0.976 . . . . 0.0 109.659 179.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.508 ' HB3' ' HZ3' ' A' ' 108' ' ' LYS . 7.4 ttpm? -60.08 -42.15 94.0 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.126 -0.984 . . . . 0.01 108.555 -179.704 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -62.62 -39.69 94.61 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.455 -0.943 . . . . 0.01 108.455 178.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.457 HG22 ' SD ' ' A' ' 114' ' ' MET . 28.6 mm -65.9 -44.58 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.223 -0.923 . . . . 0.0 108.703 179.313 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.803 ' CD2' HD23 ' A' ' 17' ' ' LEU . 1.3 m-85 -59.69 -49.48 77.56 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 178.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.31 -39.64 87.72 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.616 -0.677 . . . . 0.01 109.664 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 7.1 tt -61.5 -59.8 4.67 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.164 -0.96 . . . . 0.0 110.057 -179.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.457 ' SD ' HG22 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -69.72 -38.02 76.75 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.939 -1.101 . . . . 0.0 109.835 -179.793 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.472 ' HB2' HD22 ' A' ' 17' ' ' LEU . 85.8 tt0 -60.69 -40.15 91.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.032 -1.042 . . . . 0.01 109.67 179.664 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -87.05 -9.92 54.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.397 -1.439 . . . . 0.01 110.901 -179.045 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 121' ' ' ARG . 45.2 t0 -119.61 -69.05 0.87 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.304 -0.872 . . . . 0.0 111.937 -178.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.5 p -59.96 -38.79 83.52 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.075 -1.016 . . . . 0.01 110.645 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.566 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.1 OUTLIER -57.67 -49.97 74.72 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.189 -0.944 . . . . 0.01 109.467 -179.485 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -62.31 -40.05 95.03 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.012 -1.055 . . . . 0.01 108.528 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' A' ' 125' ' ' SER . 99.5 mtt180 -69.34 -34.78 75.13 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.388 -0.967 . . . . 0.01 108.388 179.499 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.48 ' O ' ' CB ' ' A' ' 128' ' ' TYR . 0.3 OUTLIER -59.95 -48.27 82.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.005 -1.059 . . . . 0.01 108.428 179.204 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.437 HD23 ' CZ ' ' A' ' 128' ' ' TYR . 91.8 mt -59.75 -32.42 70.56 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.943 -1.098 . . . . 0.01 108.587 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -98.73 4.32 47.77 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.454 -0.779 . . . . 0.01 110.138 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 121' ' ' ARG . 76.4 p -76.13 160.38 29.8 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.025 -1.047 . . . . 0.01 110.95 -178.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 126' ' ' ARG . 0.1 OUTLIER -69.97 -40.49 75.35 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.621 -0.674 . . . . 0.01 110.619 -179.587 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -64.35 -44.02 92.76 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.028 -1.045 . . . . 0.01 109.285 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.76 ' CE1' HG21 ' A' ' 132' ' ' THR . 64.0 t80 -60.18 -45.39 93.28 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.589 -0.695 . . . . 0.01 110.329 -179.549 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.8 mt -60.0 -48.33 82.16 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 120.669 -1.269 . . . . 0.01 109.558 -179.319 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.52 ' O ' ' ND2' ' A' ' 133' ' ' ASN . 96.3 m-20 -60.11 -49.35 78.0 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.133 -0.979 . . . . 3.77 109.333 179.691 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.12 -35.64 74.25 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -0.865 . . . . 3.8700000000000001 108.896 179.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.76 HG21 ' CE1' ' A' ' 128' ' ' TYR . 5.6 p -115.57 81.86 1.66 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.213 -1.032 . . . . 4.6299999999999999 108.213 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 130' ' ' ASP . 28.8 m-80 . . . . . 0 C--N 1.292 -1.927 0 O-C-N 120.868 -1.145 . . . . 6.4800000000000004 108.031 -179.33 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 109.204 -0.665 . . . . 18.699999999999999 109.204 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.435 ' OG ' ' OE2' ' A' ' 9' ' ' GLU . 65.0 p -77.0 162.96 27.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 15.970000000000001 110.098 -179.714 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -72.42 -22.81 61.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.505 -0.747 . . . . 13.82 110.639 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' CD ' ' A' ' 8' ' ' GLU . 33.0 mp0 -67.72 -38.06 83.06 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 120.561 -1.337 . . . . 15.06 110.166 -179.149 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.435 ' OE2' ' OG ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -73.63 -40.35 63.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.203 -0.936 . . . . 14.68 112.205 -178.174 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.598 HG21 HG22 ' A' ' 132' ' ' THR . 26.2 m -61.18 -38.9 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.204 -1.56 . . . . 11.69 110.538 -178.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.99 -39.95 87.47 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.009 -1.682 . . . . 10.51 108.067 178.303 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.598 ' HZ3' ' CB ' ' A' ' 12' ' ' LYS . 9.6 mtpm? -62.1 -38.5 89.12 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.355 -0.98 . . . . 10.82 108.355 179.062 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.562 ' O ' ' CZ ' ' A' ' 119' ' ' TYR . 39.7 m0 -59.99 -27.13 66.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.497 -0.927 . . . . 6.2599999999999998 108.497 179.019 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.71 -9.16 59.72 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.605 -1.309 . . . . 0.01 109.078 179.587 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -95.85 -30.66 13.55 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.243 -0.91 . . . . 0.01 110.908 -179.323 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' OH ' ' A' ' 119' ' ' TYR . 19.5 p -172.42 144.84 1.56 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.597 -1.314 . . . . 0.01 111.092 -179.224 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.0 tp -59.96 -40.04 87.69 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.855 -0.528 . . . . 0.01 110.544 179.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -46.33 -45.2 17.42 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.39 -0.819 . . . . 0.01 110.211 -178.136 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -63.69 -45.47 89.88 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.093 -1.004 . . . . 0.01 110.853 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 tp -60.14 -49.8 76.21 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.027 -1.046 . . . . 0.01 110.318 -179.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 27' ' ' LEU . 48.8 pt -76.83 -17.77 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.744 -1.223 . . . . 0.01 110.607 -179.235 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -89.83 -8.15 52.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.584 -1.323 . . . . 0.01 110.795 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -92.03 138.57 31.43 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.828 -1.17 . . . . 0.01 109.207 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.02 -39.84 87.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.01 109.965 -179.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.8 t -81.5 -24.31 36.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.023 -1.048 . . . . 0.01 108.211 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -68.01 -47.0 62.41 Favored Glycine 0 N--CA 1.485 1.919 0 N-CA-C 107.952 -2.059 . . . . 0.01 107.952 178.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 21' ' ' ILE . 49.1 mt -60.14 -45.55 92.65 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.445 -1.033 . . . . 0.01 109.059 179.033 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.0 -46.13 90.49 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.936 -1.102 . . . . 0.01 108.371 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.01 75.38 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 119.946 -0.702 . . . . 0.01 109.314 179.427 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.669 ' CE2' HD11 ' A' ' 34' ' ' LEU . 24.0 t80 -69.91 -40.5 75.54 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 110.511 -179.204 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HA ' HD12 ' A' ' 34' ' ' LEU . 35.5 mmtm -59.85 -46.87 87.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.705 -1.247 . . . . 0.01 109.738 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.92 77.92 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.032 -1.042 . . . . 0.01 109.112 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -60.03 -40.09 88.15 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.449 -0.782 . . . . 0.01 109.203 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.669 HD11 ' CE2' ' A' ' 30' ' ' PHE . 30.9 mt -60.05 -40.12 88.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 108.83 179.327 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -59.98 -39.91 87.29 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.441 -0.948 . . . . 0.01 108.441 179.823 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.2 m -60.39 -33.51 72.58 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 109.08 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -100.13 8.39 43.92 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.329 -0.857 . . . . 0.01 109.528 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 56.01 30.1 15.58 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.415 -0.803 . . . . 0.01 109.977 179.198 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.487 ' OG ' HD23 ' A' ' 34' ' ' LEU . 5.9 p -103.0 20.74 16.99 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.566 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 40' ' ' GLU . 3.0 pm0 -65.39 -28.32 69.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -0.903 . . . . 0.0 109.675 -179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.421 ' OE1' ' O ' ' A' ' 80' ' ' GLU . 20.8 pt-20 -62.92 -35.21 79.33 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 120.399 -1.438 . . . . 0.0 108.472 179.506 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.768 HD21 HD21 ' A' ' 82' ' ' ASN . 99.2 m-20 -62.82 -41.97 99.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.568 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.431 ' HB ' HD13 ' A' ' 34' ' ' LEU . 4.9 tp -70.03 -40.56 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 120.296 -1.503 . . . . 0.0 109.249 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -61.73 -40.68 95.94 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 178.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CE1' ' SG ' ' A' ' 49' ' ' CYS . 64.9 t80 -63.74 -41.98 97.94 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.128 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.637 ' HE1' ' NE2' ' A' ' 107' ' ' GLN . 65.0 t90 -62.97 -44.44 96.05 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.615 -0.678 . . . . 0.01 109.956 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 94.3 mt -61.11 -42.14 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.118 -0.989 . . . . 0.0 109.104 -179.5 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 82.7 p -66.51 -39.42 88.65 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.272 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.519 ' SG ' ' CE1' ' A' ' 45' ' ' PHE . 36.0 m -66.87 -37.19 83.94 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.468 -0.77 . . . . 0.01 109.495 179.402 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -59.9 -45.19 93.32 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.758 -1.214 . . . . 0.01 108.953 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -39.96 87.78 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.982 -1.118 . . . . 0.01 107.982 178.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -61.69 -34.33 75.57 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.783 -0.821 . . . . 0.01 108.783 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -79.94 -11.57 59.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.594 -0.691 . . . . 0.01 110.988 -179.374 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -89.06 -31.03 18.25 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.651 -1.281 . . . . 0.01 109.171 -179.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 96.8 mt -72.04 123.88 27.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.209 -0.932 . . . . 0.01 109.255 179.266 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -99.1 0.4 43.51 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.747 -0.835 . . . . 0.01 108.747 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.6 m -96.77 110.66 54.48 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.473 -0.767 . . . . 0.01 109.207 179.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -69.33 0.4 5.37 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 CA-C-N 120.149 1.089 . . . . 0.01 111.956 -179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 t -88.58 -29.93 19.65 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.354 -0.841 . . . . 0.01 110.152 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -89.76 -13.57 36.46 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.137 -0.977 . . . . 0.01 110.006 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.31 -40.0 94.85 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.935 -1.103 . . . . 0.01 109.834 179.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.456 ' CB ' ' CD ' ' A' ' 63' ' ' PRO . 0.4 OUTLIER -47.6 -64.25 1.13 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.19 -0.944 . . . . 0.01 110.711 -179.277 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' A' ' 62' ' ' SER . 27.0 Cg_exo -37.26 -62.46 0.28 Allowed 'Trans proline' 0 N--CA 1.488 1.202 0 C-N-CA 121.248 1.299 . . . . 0.01 113.761 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -73.21 -24.39 60.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.928 -1.108 . . . . 0.01 110.872 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.68 -50.02 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.928 -1.107 . . . . 0.01 108.894 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.77 -41.18 99.12 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.285 -0.885 . . . . 0.01 109.67 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -61.3 -50.02 74.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.157 -0.964 . . . . 0.01 109.232 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.74 -49.71 78.92 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 O-C-N 121.384 -0.822 . . . . 0.01 109.088 179.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' HG21 ' A' ' 73' ' ' ILE . 60.3 t80 -61.1 -49.96 75.21 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.316 -0.865 . . . . 0.01 110.207 -179.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -62.59 -33.36 74.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.26 -0.9 . . . . 0.01 109.535 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -80.01 -69.33 0.6 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.395 -0.816 . . . . 0.0 111.612 -178.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -83.14 -29.28 28.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.047 -1.033 . . . . 0.0 113.692 -176.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG21 ' CE2' ' A' ' 69' ' ' TYR . 8.2 mm -96.43 -13.45 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 120.383 -1.448 . . . . 0.01 111.958 -177.232 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.7 t -57.12 129.33 41.27 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.313 -1.492 . . . . 0.01 108.677 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.74 -18.06 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.026 -1.046 . . . . 0.01 108.665 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -97.52 0.56 47.71 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.493 -0.928 . . . . 0.01 108.493 178.801 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -47.77 134.19 13.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.347 -0.846 . . . . 0.01 109.424 -179.694 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -70.04 -17.19 63.25 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.258 -0.901 . . . . 0.01 108.674 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 40.3 pttt -132.99 73.84 1.54 Allowed 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.489 0.661 . . . . 0.01 109.426 179.639 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.421 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 99.1 mt-10 -61.32 142.42 56.89 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.316 -0.865 . . . . 0.01 109.586 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.54 ' O ' ' NH2' ' A' ' 88' ' ' ARG . 3.3 m -100.47 147.76 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.768 HD21 HD21 ' A' ' 42' ' ' ASN . 5.5 p30 -75.07 111.53 10.39 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.222 -0.924 . . . . 0.0 109.603 -179.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 82.8 mt -144.55 168.18 20.76 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.979 -0.749 . . . . 0.01 108.979 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.55 ' OD1' ' N ' ' A' ' 85' ' ' SER . 52.6 t0 -70.74 157.77 37.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.401 -0.812 . . . . 0.01 108.997 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.55 ' N ' ' OD1' ' A' ' 84' ' ' ASP . 72.8 m -67.96 -25.11 65.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.23 -0.919 . . . . 0.01 109.627 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.4 p -83.89 -31.02 25.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.13 -0.981 . . . . 0.01 109.42 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.2 m -60.59 -41.34 94.52 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.122 -0.986 . . . . 0.01 109.584 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.54 ' NH2' ' O ' ' A' ' 81' ' ' VAL . 61.5 mtt-85 -59.92 -48.82 80.15 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.092 -1.005 . . . . 0.01 108.356 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.2 -39.99 92.29 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.553 -0.717 . . . . 0.01 109.205 179.129 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 105' ' ' GLU . 88.7 tt0 -59.91 -46.51 89.14 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.272 -0.892 . . . . 0.01 109.451 -179.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 27.7 m -62.64 -44.01 97.35 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.997 -1.064 . . . . 0.01 108.991 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 85.8 p -61.04 -40.89 95.35 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.01 108.941 179.309 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH1' ' CB ' ' A' ' 93' ' ' ARG . 9.4 mtp-105 -66.81 -32.69 74.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.399 -0.813 . . . . 0.01 109.479 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.543 ' CB ' ' SG ' ' A' ' 102' ' ' CYS . 30.7 m120 -63.01 -19.25 64.17 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.29 -0.881 . . . . 0.01 108.88 -179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 22.6 mmt -59.99 -39.96 87.51 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.235 -1.024 . . . . 0.01 108.235 179.199 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.53 -37.79 88.77 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.5 -0.926 . . . . 0.01 108.5 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -143.1 79.08 14.66 Favored Pre-proline 0 N--CA 1.492 1.655 0 N-CA-C 108.964 -0.754 . . . . 0.01 108.964 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -60.81 119.03 5.97 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 120.806 1.004 . . . . 0.01 111.908 -179.699 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 32.7 p -123.77 170.14 10.83 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.01 109.475 -179.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.5 -16.12 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 108.603 -0.888 . . . . 0.01 108.603 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 81.9 p -92.6 2.43 56.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.319 -0.863 . . . . 0.01 109.496 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.543 ' SG ' ' CB ' ' A' ' 94' ' ' ASN . 9.5 t -60.39 -55.66 30.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 0.01 110.537 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -96.64 -3.5 42.69 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.05 -1.031 . . . . 0.01 111.296 -178.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -61.04 -40.03 92.06 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.767 -1.208 . . . . 0.01 109.369 -179.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' A' ' 90' ' ' GLU . 82.9 tt0 -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.196 -0.94 . . . . 0.01 109.034 179.802 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -68.07 -40.71 82.66 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.222 -0.924 . . . . 0.0 109.476 -179.721 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.637 ' NE2' ' HE1' ' A' ' 46' ' ' TRP . 34.3 tt0 -60.03 -40.11 88.23 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.89 -1.131 . . . . 0.0 108.87 179.445 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.412 ' O ' ' ND2' ' A' ' 112' ' ' ASN . 7.3 ttpm? -59.98 -40.03 87.72 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.196 -1.038 . . . . 0.01 108.196 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -64.74 -40.23 94.97 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.545 -0.909 . . . . 0.01 108.545 179.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 44.0 mm -70.11 -43.57 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.222 179.211 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.57 -49.96 75.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.047 -1.033 . . . . 0.0 109.153 179.766 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 108' ' ' LYS . 67.9 m-80 -61.78 -43.73 98.27 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 120.544 -1.347 . . . . 0.01 110.34 -179.295 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.46 -55.04 27.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.067 -1.021 . . . . 0.0 110.503 -178.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.514 ' O ' ' N ' ' A' ' 118' ' ' SER . 14.4 ptm -65.19 -42.11 93.89 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.107 -0.995 . . . . 0.0 110.015 -179.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.49 -43.74 98.32 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.681 -1.262 . . . . 0.01 110.807 -179.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.96 -39.92 75.72 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 120.583 -1.323 . . . . 0.01 111.027 -178.732 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -97.99 -37.26 9.84 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.983 -1.073 . . . . 0.0 112.093 -178.444 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 114' ' ' MET . 15.7 p -79.97 -55.55 4.88 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.429 -1.419 . . . . 0.01 111.544 -177.757 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.562 ' CZ ' ' O ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.99 -48.85 72.75 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.994 -1.066 . . . . 0.01 110.455 -178.361 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.459 HH11 ' HG3' ' A' ' 120' ' ' ARG . 20.3 mmm-85 -59.96 -43.63 94.92 Favored 'General case' 0 C--N 1.293 -1.853 0 C-N-CA 118.806 -1.157 . . . . 0.01 108.093 -179.237 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' O ' ' N ' ' A' ' 125' ' ' SER . 30.4 mmt180 -70.38 -39.12 74.74 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.463 -0.773 . . . . 0.01 109.202 178.895 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 118' ' ' SER . 0.9 OUTLIER -56.19 -52.68 63.53 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.16 -0.963 . . . . 0.01 109.798 -179.235 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.99 -39.82 87.03 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.997 -1.064 . . . . 0.01 108.788 -179.63 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -83.62 -7.88 59.41 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.277 -0.889 . . . . 0.01 109.476 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 121' ' ' ARG . 77.2 p -70.1 159.93 32.98 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.086 -1.009 . . . . 0.01 109.212 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.495 ' HD3' ' H ' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -70.19 -29.95 66.95 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.549 -0.72 . . . . 0.01 109.811 179.553 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -60.87 -57.72 11.46 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.892 -1.13 . . . . 0.01 109.572 -179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.711 ' CZ ' HG21 ' A' ' 132' ' ' THR . 59.4 t80 -60.0 -49.93 75.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.312 -0.867 . . . . 0.01 109.635 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.1 -50.45 73.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.01 110.253 -179.118 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 133' ' ' ASN . 96.0 m-20 -60.15 -43.66 95.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.935 -1.103 . . . . 3.77 108.654 179.773 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 59.4 mt -70.66 -34.29 71.87 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.757 -0.831 . . . . 3.8700000000000001 108.757 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.711 HG21 ' CZ ' ' A' ' 128' ' ' TYR . 30.2 p -107.94 72.46 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.579 -0.701 . . . . 4.6299999999999999 109.31 -179.763 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.44 ' OD1' ' O ' ' A' ' 130' ' ' ASP . 28.2 m120 . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 108.461 -0.94 . . . . 6.4800000000000004 108.461 179.834 . . . . . . . . 1 1 . 1 stop_ save_