data_1owa_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 1owa _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 ' 20' ' ' THR . . . . . 0.556 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 121.196 0.522 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.504 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 20' ' ' THR . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.446 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.446 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.463 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER . . . . . 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.486 ' HB2' HG23 ' A' ' 114' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.488 ' CB ' HD23 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.423 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.652 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.926 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.617 ' CD1' HD21 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.652 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.915 ' HB2' HD22 ' A' ' 143' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.703 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.405 ' N ' HG11 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.765 HG21 ' O ' ' A' ' 72' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.616 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.616 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.715 ' HD3' HD12 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.519 ' HD1' HG23 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.653 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.708 ' HB3' ' HE2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.653 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.926 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.498 HG12 ' CH2' ' A' ' 140' ' ' TRP . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.65 ' HE3' HD23 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.73 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.635 HD13 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.73 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 107' ' ' LEU . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.644 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.584 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.644 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.463 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 . . . . . 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.584 ' HE3' ' HD2' ' A' ' 115' ' ' ARG . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.409 ' CD2' HD13 ' A' ' 136' ' ' LEU . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 130' ' ' LYS . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.561 ' CD1' ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.589 ' HE1' ' HG2' ' A' ' 104' ' ' LYS . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.536 HD23 HD21 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.915 HD22 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.481 HD22 HD12 ' A' ' 148' ' ' LEU . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.536 HD21 HD23 ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.481 HD12 HD22 ' A' ' 144' ' ' LEU . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 . . . . . 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.61 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 C--O 1.223 -0.309 0 CA-C-O 120.787 0.327 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.52 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.61 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.603 HG12 ' O ' ' A' ' 20' ' ' THR . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.61 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 ttp85 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.424 ' CE1' HD13 ' A' ' 111' ' ' LEU . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.403 ' CB ' ' HE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.732 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.737 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.743 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.496 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.77 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.775 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.608 ' O ' ' HB3' ' A' ' 80' ' ' SER . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.775 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.539 ' HE3' ' HE3' ' A' ' 150' ' ' LYS . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.632 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.464 ' HE2' HD13 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.86 ' HA ' HD11 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.648 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.648 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.459 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.737 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.482 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.834 ' HG3' HD12 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.734 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.754 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.754 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.503 ' O ' HG23 ' A' ' 133' ' ' ILE . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.403 ' HE2' ' CB ' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.834 HD12 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.499 ' N ' HG23 ' A' ' 133' ' ' ILE . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.563 ' O ' HD11 ' A' ' 139' ' ' LEU . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 135' ' ' GLU . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.555 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.568 HD22 HD13 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 149' ' ' GLU . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.628 ' HB3' HD23 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 145' ' ' GLU . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.539 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.553 HG23 ' HG2' ' A' ' 22' ' ' GLU . 17.2 m . . . . . 0 C--O 1.223 -0.3 0 CA-C-O 121.139 0.495 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.436 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.553 ' HG2' HG23 ' A' ' 20' ' ' THR . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.441 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.634 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.615 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp . . . . . 0 CA--C 1.512 -0.49 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.453 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.655 ' HZ ' HG21 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.429 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.775 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.79 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.694 HD12 HD22 ' A' ' 143' ' ' LEU . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.775 ' HE2' ' HA ' ' A' ' 67' ' ' LYS . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.618 ' HZ3' ' HB3' ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.53 HD13 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.732 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.639 HG22 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.732 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.561 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 64.0 tt0 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.464 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.646 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.562 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 75.3 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.53 ' HD3' HD13 ' A' ' 75' ' ' ILE . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.646 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.618 ' HB3' ' HZ3' ' A' ' 72' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.69 ' O ' HG21 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.79 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . 0.472 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.601 ' O ' HD13 ' A' ' 107' ' ' LEU . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.684 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.455 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 103' ' ' THR . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.727 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.683 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.507 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.617 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.829 0.347 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.655 HG21 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.433 ' CD2' HD12 ' A' ' 136' ' ' LEU . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 130' ' ' LYS . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.672 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB3' HD13 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HB2' ' O ' ' A' ' 136' ' ' LEU . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.616 ' O ' HD12 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.694 HD22 HD12 ' A' ' 69' ' ' ILE . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.464 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.72 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m . . . . . 0 C--O 1.226 -0.132 0 CA-C-O 121.15 0.5 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.72 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.651 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.511 HH12 ' HG2' ' A' ' 23' ' ' GLU . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.577 ' O ' HG21 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.577 HG21 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.725 HD21 ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.633 ' HZ ' HG22 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.725 ' HE3' HD21 ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.494 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.853 ' HB3' HD23 ' A' ' 136' ' ' LEU . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.606 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.782 HD13 HD13 ' A' ' 139' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.567 ' HA ' ' CG1' ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' A' ' 75' ' ' ILE . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.567 ' CG1' ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.485 HG21 ' N ' ' A' ' 76' ' ' LEU . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.624 HD13 ' HE2' ' A' ' 79' ' ' LYS . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.634 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.624 ' HE2' HD13 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m . . . . . 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.432 ' HZ3' HD12 ' A' ' 75' ' ' ILE . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.616 ' CD2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 36.4 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 100' ' ' GLU . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.609 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.606 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.604 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.568 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.654 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' HD21 ' A' ' 107' ' ' LEU . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.654 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.793 0.33 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.633 HG22 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.463 ' O ' HG21 ' A' ' 133' ' ' ILE . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.621 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.47 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.853 HD23 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.782 HD13 HD13 ' A' ' 69' ' ' ILE . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.636 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.419 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.621 HD11 HG21 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.431 HD12 HD23 ' A' ' 76' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.616 HG22 ' CD2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.626 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 24' ' ' ILE . 7.4 m . . . . . 0 C--O 1.225 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.477 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.416 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.766 ' O ' HD22 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 28' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.495 HD11 ' HZ3' ' A' ' 59' ' ' LYS . 3.1 tm? . . . . . 0 CA--C 1.518 -0.261 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.564 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.656 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.739 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.754 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.651 HG23 HD22 ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.739 ' HE3' ' HA ' ' A' ' 67' ' ' LYS . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.793 ' HD3' HD21 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.716 HG12 ' HA ' ' A' ' 70' ' ' MET . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.462 ' N ' HG11 ' A' ' 73' ' ' VAL . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.774 HD11 HD23 ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 72' ' ' LYS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.535 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.492 ' NZ ' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.535 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t . . . . . 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.594 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 . . . . . 0 C--O 1.228 -0.077 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.594 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.62 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 92.6 m-70 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.793 HD21 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.679 ' HA ' ' CZ2' ' A' ' 68' ' ' TRP . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.66 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.765 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.765 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.801 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.801 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.69 ' HD2' HG23 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 . . . . . 0 C--O 1.23 0.037 0 CA-C-O 120.738 0.304 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.69 HG23 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 133' ' ' ILE . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 130' ' ' LYS . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.625 HD12 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.577 ' O ' HD11 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.66 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.627 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HA ' HD13 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.444 ' O ' HD22 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.668 HD13 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.486 ' N ' HD23 ' A' ' 148' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.403 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.492 ' HD2' ' NZ ' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.69 HG22 ' HG2' ' A' ' 22' ' ' GLU . 2.1 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.69 ' HG2' HG22 ' A' ' 20' ' ' THR . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.466 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 20' ' ' THR . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.496 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 62.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.401 ' O ' HG21 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.401 HG21 ' O ' ' A' ' 27' ' ' ARG . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.541 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.541 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.413 HD21 ' CZ3' ' A' ' 140' ' ' TRP . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.604 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.647 ' O ' HG11 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.631 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.578 ' HD2' ' CG ' ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.647 HG11 ' O ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.631 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.539 ' N ' ' OD1' ' A' ' 74' ' ' ASN . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.77 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.541 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.509 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.541 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t . . . . . 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.79 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.79 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.497 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.2 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 93' ' ' LYS . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.604 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 97' ' ' LEU . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.618 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.537 HD13 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.618 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' A' ' 107' ' ' LEU . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.676 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.411 ' HB2' ' CE2' ' A' ' 58' ' ' PHE . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.676 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 8.4 mtt-85 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.412 ' O ' HD11 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.412 HD11 ' O ' ' A' ' 132' ' ' HIS . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.49 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.417 ' HA ' HD13 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.578 ' CG ' ' HD2' ' A' ' 72' ' ' LYS . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.878 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.878 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.535 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.183 0.516 . . . . 0.0 111.643 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.535 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 20' ' ' THR . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.562 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.656 ' O ' HG23 ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 28' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.435 HD13 ' HG2' ' A' ' 28' ' ' ARG . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.626 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.668 HG12 ' NH2' ' A' ' 118' ' ' ARG . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.727 ' CE1' HD13 ' A' ' 111' ' ' LEU . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.553 ' HB2' ' NE2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.849 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.815 ' O ' HG21 ' A' ' 73' ' ' VAL . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.884 ' HD2' HD13 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.815 HG21 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.989 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 1.022 HD23 HD13 ' A' ' 146' ' ' LEU . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.758 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.474 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.834 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.758 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.468 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.8 ' HA ' ' HE2' ' A' ' 93' ' ' LYS . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.989 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.699 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.697 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 98.1 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.884 HD13 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.861 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.849 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.687 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.861 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.456 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.687 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.727 HD13 ' CE1' ' A' ' 58' ' ' PHE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.435 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.668 ' NH2' HG12 ' A' ' 57' ' ' VAL . 85.1 mtt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.764 0.316 . . . . 0.0 111.518 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.59 ' O ' HG23 ' A' ' 133' ' ' ILE . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.553 ' NE2' ' HB2' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.59 HG23 ' O ' ' A' ' 130' ' ' LYS . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.547 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.547 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.496 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.661 ' CD1' HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 1.022 HD13 HD23 ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.72 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.651 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.9 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.86 0.362 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.604 ' O ' HG22 ' A' ' 24' ' ' ILE . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 20' ' ' THR . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.651 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 21' ' ' ALA . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.658 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.636 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.478 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 7.8 tt . . . . . 0 CA--C 1.517 -0.308 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.569 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HB3' ' O ' ' A' ' 62' ' ' ALA . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.742 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.673 ' O ' HG13 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.409 ' O ' HG21 ' A' ' 75' ' ' ILE . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.649 ' HB3' HD12 ' A' ' 143' ' ' LEU . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.643 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.431 ' CD2' HD12 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.615 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 150' ' ' LYS . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.582 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.524 ' CD2' HG21 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.634 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.726 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.742 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.725 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.589 HD11 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.725 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.442 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.569 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.48 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 . . . . . 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.635 0.255 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.57 ' CD2' HD13 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.57 HD13 ' CD2' ' A' ' 132' ' ' HIS . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.475 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 72' ' ' LYS . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.736 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.736 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.406 ' HA2' ' NZ ' ' A' ' 90' ' ' LYS . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.705 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 121.337 0.589 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.43 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.705 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 20' ' ' THR . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.519 ' O ' HG22 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp . . . . . 0 CA--C 1.515 -0.399 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.518 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HZ ' HG22 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HB3' ' CE1' ' A' ' 132' ' ' HIS . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.726 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.638 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.507 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.726 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.521 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.772 ' O ' HG12 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.682 ' HA ' HG23 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.772 HG12 ' O ' ' A' ' 69' ' ' ILE . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.428 ' N ' HG22 ' A' ' 73' ' ' VAL . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.714 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.801 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.621 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m . . . . . 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.927 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.455 ' O ' ' HD3' ' A' ' 93' ' ' LYS . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.816 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.927 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.629 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.727 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.68 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.799 HD22 ' HG3' ' A' ' 72' ' ' LYS . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.68 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.521 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.695 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.654 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.643 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 58' ' ' PHE . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.675 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.436 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.805 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.8 ttm-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 . . . . . 0 CA--C 1.523 -0.069 0 CA-C-O 120.57 0.224 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.805 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.502 ' O ' HD12 ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.702 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.413 ' O ' HD22 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.634 HD23 ' N ' ' A' ' 139' ' ' LEU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.695 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' HD11 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.735 HD11 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.609 ' CD2' HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.703 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.78 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . 0.816 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.726 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m . . . . . 0 N--CA 1.46 0.056 0 CA-C-O 121.293 0.568 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.653 ' HG2' HG23 ' A' ' 20' ' ' THR . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.726 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.445 HG21 HD11 ' A' ' 24' ' ' ILE . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.655 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.655 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.403 ' O ' HG22 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.424 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.585 ' HZ ' HG22 ' A' ' 129' ' ' THR . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.647 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.552 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.712 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.68 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.906 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.836 ' O ' HG21 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.756 ' HG2' ' O ' ' A' ' 69' ' ' ILE . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.642 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.6 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t . . . . . 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.581 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.465 0.174 . . . . 0.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.578 ' HE2' ' NZ ' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' NE2' ' A' ' 95' ' ' GLN . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.642 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 100' ' ' GLU . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.651 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.68 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.549 HG22 ' CZ2' ' A' ' 68' ' ' TRP . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.712 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.672 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.672 ' HB3' ' O ' ' A' ' 105' ' ' SER . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' A' ' 107' ' ' LEU . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.432 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.432 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.585 HG22 ' HZ ' ' A' ' 58' ' ' PHE . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.757 ' O ' HD11 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.505 HD12 ' HG3' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.705 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.757 HD11 ' O ' ' A' ' 132' ' ' HIS . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.705 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.529 HD23 HG22 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' TRP . . . . . 0.632 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.768 HD11 HG23 ' A' ' 69' ' ' ILE . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.699 HD13 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.578 ' NZ ' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.815 0.341 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -70.02 -35.85 74.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -72.8 147.43 45.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -85.67 128.69 57.78 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.05 133.91 24.19 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.685 2.257 . . . . 0.0 112.349 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.74 139.98 42.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -98.08 120.02 37.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.889 0.376 . . . . 0.0 110.804 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.5 m -81.04 129.59 34.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.75 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.567 ' HB ' ' HB2' ' A' ' 12' ' ' SER . 18.8 t -91.89 128.25 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.448 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.7 t -78.87 127.34 39.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 111.856 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 60.04 27.25 16.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.449 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.567 ' HB2' ' HB ' ' A' ' 9' ' ' VAL . 17.2 t -73.96 -42.07 61.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.502 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.8 m -78.27 -7.11 56.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.146 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.04 76.56 0.41 Allowed Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.031 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.92 126.37 11.85 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.597 2.198 . . . . 0.0 111.593 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 15.0 ttmt -80.05 100.63 8.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.142 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -80.45 131.81 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.718 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.6 mt -77.65 108.95 11.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 111.11 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.564 ' HB3' HD11 ' A' ' 24' ' ' ILE . 99.7 mt-10 -122.78 110.04 14.97 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.556 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m -82.69 158.51 22.91 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.584 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.504 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.564 HD11 ' HB3' ' A' ' 19' ' ' GLU . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.446 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.446 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.578 ' HG2' ' HE2' ' A' ' 38' ' ' PHE . 59.8 ttt85 -62.11 -40.04 94.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.49 -40.92 84.11 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.159 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.538 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 73.1 tp60 -59.96 -42.15 93.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.925 0.393 . . . . 0.0 110.064 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.478 ' HA ' ' OE1' ' A' ' 40' ' ' GLU . 39.7 t -61.54 -40.05 93.28 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.384 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.578 ' HE2' ' HG2' ' A' ' 34' ' ' ARG . 38.4 m-85 -61.84 -45.99 91.4 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -60.26 -39.12 85.64 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.559 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 47.8 mt-10 -59.98 -40.12 88.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.25 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.4 -40.03 89.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.207 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 38' ' ' PHE . 76.6 t -60.0 -41.56 86.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.17 -178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.65 94.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.18 0.514 . . . . 0.0 110.975 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.04 -39.81 87.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.197 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 -58.2 -40.03 80.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.619 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -49.2 94.81 0.01 OUTLIER Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.814 -0.708 . . . . 0.0 113.046 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 120.18 23.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 0.0 110.776 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -89.86 120.03 30.74 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.577 HD23 ' N ' ' A' ' 49' ' ' LEU . 3.4 mm? 56.64 101.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.884 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 -162.36 -102.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.642 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -85.83 113.68 22.18 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-O 120.928 0.394 . . . . 0.0 111.204 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.5 m -70.04 150.02 47.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.334 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.469 ' CZ ' ' CE1' ' A' ' 54' ' ' HIS . 55.1 p90 -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.137 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.582 ' HA ' HG21 ' A' ' 57' ' ' VAL . 75.1 m80 -59.97 -39.89 87.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.181 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.463 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER -60.0 -42.34 94.06 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.357 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.582 HG21 ' HA ' ' A' ' 54' ' ' HIS . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.486 ' HB2' HG23 ' A' ' 114' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.488 ' CB ' HD23 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.423 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.652 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.926 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.617 ' CD1' HD21 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.652 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.915 ' HB2' HD22 ' A' ' 143' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.703 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.405 ' N ' HG11 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.765 HG21 ' O ' ' A' ' 72' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.616 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.445 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.616 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m -61.7 -40.08 93.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.445 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 88.0 m-85 -59.95 -43.5 94.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.983 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -151.93 154.29 35.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -113.27 103.49 55.55 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.55 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.58 ' HD2' ' HE2' ' A' ' 90' ' ' LYS . 52.0 Cg_exo -51.58 142.0 41.1 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.582 2.188 . . . . 0.0 111.864 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.9 m -72.77 -39.99 66.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -77.01 123.3 26.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.203 0.525 . . . . 0.0 111.414 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.99 -39.93 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.177 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -58.55 -30.05 66.84 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.58 ' HE2' ' HD2' ' A' ' 84' ' ' PRO . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.45 ' HA ' HD12 ' A' ' 154' ' ' LEU . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.715 ' HD3' HD12 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.519 ' HD1' HG23 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.653 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.708 ' HB3' ' HE2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.653 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.926 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.498 HG12 ' CH2' ' A' ' 140' ' ' TRP . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.65 ' HE3' HD23 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.73 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.635 HD13 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.73 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 107' ' ' LEU . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.644 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 117' ' ' GLU . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.584 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.644 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.463 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 -59.0 144.07 46.32 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -80.04 160.07 25.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.414 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 121' ' ' MET . 13.4 t -75.57 -170.09 1.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.819 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' MET . . . . . 0.502 ' HB2' ' O ' ' A' ' 120' ' ' THR . 66.3 mtt 70.68 13.41 7.25 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.784 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -144.24 60.05 0.51 Allowed Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.611 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 77.5 m80 -64.66 -40.04 94.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 111.163 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.0 p -61.77 -39.99 93.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.863 0.363 . . . . 0.0 110.988 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.06 -23.44 63.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.611 ' HB3' ' O ' ' A' ' 123' ' ' HIS . 53.1 t-80 -66.02 -44.33 85.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.017 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.421 ' HA ' ' OE1' ' A' ' 127' ' ' GLU . 7.7 mm-40 -60.65 -42.25 96.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.472 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.69 -40.0 95.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.964 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.584 ' HE3' ' HD2' ' A' ' 115' ' ' ARG . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.409 ' CD2' HD13 ' A' ' 136' ' ' LEU . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 130' ' ' LYS . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.561 ' CD1' ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.589 ' HE1' ' HG2' ' A' ' 104' ' ' LYS . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.536 HD23 HD21 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.915 HD22 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.481 HD22 HD12 ' A' ' 148' ' ' LEU . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.536 HD21 HD23 ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.481 HD12 HD22 ' A' ' 144' ' ' LEU . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 154' ' ' LEU . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -68.22 -32.53 72.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.511 HD21 ' HB2' ' A' ' 90' ' ' LYS . 83.6 mt -69.28 -25.69 64.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 58.8 tp -67.07 130.2 42.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.943 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.257 -0.877 . . . . 0.0 110.854 -179.955 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 1' ' ' MET . 57.6 ttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.761 0.315 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -81.13 -10.16 59.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -78.38 146.54 34.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.869 0.366 . . . . 0.0 111.109 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -85.9 141.05 35.37 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.589 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 132.98 33.82 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.213 1.942 . . . . 0.0 111.961 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -167.38 140.91 3.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.661 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.53 131.87 42.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.444 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.4 m -80.0 135.07 36.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.152 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.4 m -88.3 122.33 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.882 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 10' ' ' VAL . 10.4 p -81.43 124.58 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.009 0.433 . . . . 0.0 111.149 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -79.03 146.37 33.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.517 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.1 m -70.23 -40.07 74.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.771 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.7 m -78.46 129.23 34.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' HG21 ' A' ' 17' ' ' VAL . . . -167.21 55.29 0.23 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.884 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.29 117.3 4.33 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.248 1.965 . . . . 0.0 111.915 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.9 mttt 59.41 45.57 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.556 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 14' ' ' GLY . 41.1 t -75.38 130.02 36.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.058 0.456 . . . . 0.0 111.221 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.6 mt -75.97 145.56 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.12 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -120.98 110.32 16.14 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.61 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -85.39 149.44 25.42 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.206 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.52 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.61 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.603 HG12 ' O ' ' A' ' 20' ' ' THR . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.61 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.499 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 27.2 ttp85 -59.98 -40.4 88.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.95 -43.68 94.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.627 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -65.17 -39.92 93.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.654 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 33.7 t -60.66 -39.9 90.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.059 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.499 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 10.0 m-85 -60.71 -49.56 77.01 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.506 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.5 ttpt -61.31 -39.94 92.32 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 45.4 mt-10 -62.25 -39.99 94.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.344 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 37' ' ' SER . 97.6 mtt180 -66.23 -39.94 89.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 39' ' ' LYS . 34.1 m -69.64 -40.27 79.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' N ' HG21 ' A' ' 42' ' ' VAL . . . -62.28 -48.71 78.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.045 0.45 . . . . 0.0 111.535 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.96 -43.71 94.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.495 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.647 ' HD3' ' HD2' ' A' ' 48' ' ' LYS . 40.7 ttm180 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.725 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.27 -153.89 52.18 Favored Glycine 0 C--N 1.329 0.149 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -76.84 118.24 19.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.057 0.456 . . . . 0.0 110.433 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.647 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 9.6 mtpm? -81.53 152.32 27.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.674 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 83.6 mt -80.05 -13.32 59.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.266 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.587 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.8 mt-10 80.45 -44.09 0.24 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 122.677 0.391 . . . . 0.0 111.077 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -152.98 107.48 3.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.553 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -70.01 141.69 52.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -64.44 -20.01 65.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.307 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.623 ' HA ' HG22 ' A' ' 57' ' ' VAL . 69.1 m80 -59.96 -38.9 83.84 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.502 ' HB2' ' HE2' ' A' ' 119' ' ' PHE . 2.8 tm? -60.07 -44.95 94.39 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 54' ' ' HIS . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.424 ' CE1' HD13 ' A' ' 111' ' ' LEU . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.403 ' CB ' ' HE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.732 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.737 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.743 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.496 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.77 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.775 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.608 ' O ' ' HB3' ' A' ' 80' ' ' SER . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.775 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t -62.19 -39.79 93.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.68 ' HD2' ' HG3' ' A' ' 82' ' ' GLU . 64.8 t80 -58.52 -43.43 89.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.014 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.68 ' HG3' ' HD2' ' A' ' 81' ' ' TYR . 64.1 mt-10 -115.07 143.27 45.45 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.741 0.305 . . . . 0.0 110.944 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.458 ' N ' ' HD3' ' A' ' 84' ' ' PRO . 2.4 t70 -121.43 51.26 2.55 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.447 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 82' ' ' GLU . 79.7 Cg_endo -84.53 149.5 11.49 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.688 2.258 . . . . 0.0 111.842 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.1 m -83.3 -73.12 0.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.866 0.365 . . . . 0.0 110.682 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.7 121.89 24.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.698 HD11 ' HB2' ' A' ' 90' ' ' LYS . 7.4 tt -162.74 89.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.448 0.642 . . . . 0.0 111.649 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 -60.56 -39.93 89.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.525 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.698 ' HB2' HD11 ' A' ' 87' ' ' ILE . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.632 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.464 ' HE2' HD13 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.86 ' HA ' HD11 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.648 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.648 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.459 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.737 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.482 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.834 ' HG3' HD12 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.734 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.47 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.754 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -103.1 140.04 37.83 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.502 ' HE2' ' HB2' ' A' ' 55' ' ' LEU . 95.7 m-85 60.4 65.67 1.04 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.09 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 121' ' ' MET . 18.2 p -74.77 154.65 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.007 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' MET . . . . . 0.447 ' HB2' ' O ' ' A' ' 120' ' ' THR . 97.3 mtp 67.73 10.4 7.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.509 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -101.39 93.77 1.17 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.979 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -67.65 -40.1 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 0.0 111.235 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.9 m -63.49 -40.09 96.17 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.833 0.349 . . . . 0.0 111.192 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.59 -22.46 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.32 -42.85 82.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.256 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.49 -42.61 96.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.4 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.35 -42.57 79.05 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.754 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.503 ' O ' HG23 ' A' ' 133' ' ' ILE . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.403 ' HE2' ' CB ' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.834 HD12 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.499 ' N ' HG23 ' A' ' 133' ' ' ILE . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.563 ' O ' HD11 ' A' ' 139' ' ' LEU . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 135' ' ' GLU . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.555 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.568 HD22 HD13 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 149' ' ' GLU . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.628 ' HB3' HD23 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 145' ' ' GLU . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.539 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.422 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.3 -31.75 70.45 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.41 HD21 ' O ' ' A' ' 154' ' ' LEU . 10.3 tt -69.11 -26.39 64.89 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.811 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 88.9 mt -68.36 137.4 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.05 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.764 179.88 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 120.923 0.392 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -71.95 -30.06 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -76.0 129.53 37.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.035 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -86.28 114.5 57.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.05 135.06 12.08 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.561 2.174 . . . . 0.0 112.375 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -75.63 134.6 40.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.719 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -100.03 124.36 45.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 71.7 p -79.93 135.59 36.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.4 m -84.95 132.66 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.216 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.8 t -80.7 129.99 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -77.23 145.32 37.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.733 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.1 m -79.71 -10.38 59.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.311 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.606 ' O ' ' HD3' ' A' ' 15' ' ' PRO . 38.1 p 49.61 41.78 22.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.569 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -87.19 102.96 2.83 Favored Glycine 0 CA--C 1.521 0.406 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.484 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.606 ' HD3' ' O ' ' A' ' 13' ' ' SER . 83.1 Cg_endo -80.4 146.16 17.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.746 2.297 . . . . 0.0 112.487 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.6 mttm 64.25 118.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.99 133.11 32.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.187 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 tp -75.48 131.37 40.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.424 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.573 ' HB3' ' CG1' ' A' ' 24' ' ' ILE . 76.1 mm-40 -122.35 109.25 14.19 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.553 HG23 ' HG2' ' A' ' 22' ' ' GLU . 17.2 m -81.03 161.33 24.26 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.854 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.436 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.553 ' HG2' HG23 ' A' ' 20' ' ' THR . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.441 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.634 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.423 ' O ' ' HD2' ' A' ' 35' ' ' TYR . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -62.96 -42.03 99.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.423 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 39.4 m-85 -59.9 -44.45 94.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.8 0.333 . . . . 0.0 111.101 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.2 mt-30 -69.96 -40.53 75.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 67.6 m -60.99 -39.98 91.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.038 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.74 -49.56 77.0 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -61.16 -39.96 92.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 114.533 -1.212 . . . . 0.0 108.265 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.3 mt-10 -60.91 -41.42 96.08 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.29 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 37' ' ' SER . 60.5 mtp180 -60.02 -40.08 88.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.846 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.45 -47.87 85.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.07 94.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.68 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.6 mt-10 -59.97 -40.08 87.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.939 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.5 mtm105 -59.91 -40.11 87.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.591 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 56.99 -161.68 7.76 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.567 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -78.23 116.39 18.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.871 0.367 . . . . 0.0 110.613 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -84.65 149.47 25.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.11 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.624 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 61.8 tp -69.93 -40.03 75.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.444 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.624 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 48.7 mt-10 87.57 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.011 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -83.61 164.61 19.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.876 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 m -69.62 123.92 22.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.529 ' O ' HG21 ' A' ' 57' ' ' VAL . 2.2 t80 -60.09 -19.78 54.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.516 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.506 ' HA ' ' CG2' ' A' ' 57' ' ' VAL . 74.4 m80 -60.75 -41.29 95.12 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.615 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp -69.95 -47.56 61.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.453 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.529 HG21 ' O ' ' A' ' 53' ' ' TYR . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.655 ' HZ ' HG21 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.429 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.656 HD13 ' HB3' ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.775 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.79 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.694 HD12 HD22 ' A' ' 143' ' ' LEU . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.775 ' HE2' ' HA ' ' A' ' 67' ' ' LYS . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.618 ' HZ3' ' HB3' ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.53 HD13 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.732 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.639 HG22 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.732 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.561 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t -62.01 -47.1 86.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.531 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 64.4 t80 -60.02 -48.69 80.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.022 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.531 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 40.1 mt-10 -138.61 155.53 48.24 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.767 0.318 . . . . 0.0 110.817 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -130.3 75.49 79.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.654 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HD2' ' NZ ' ' A' ' 90' ' ' LYS . 50.8 Cg_exo -52.16 147.19 28.25 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.273 1.982 . . . . 0.0 111.951 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.6 t -84.01 -3.57 58.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.349 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -77.09 108.49 10.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.979 0.418 . . . . 0.0 111.277 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.3 -39.9 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.674 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 64.0 tt0 -59.62 -40.05 86.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.464 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.646 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.562 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 75.3 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.53 ' HD3' HD13 ' A' ' 75' ' ' ILE . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.646 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.618 ' HB3' ' HZ3' ' A' ' 72' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.69 ' O ' HG21 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.79 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . 0.472 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.601 ' O ' HD13 ' A' ' 107' ' ' LEU . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.684 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.455 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 103' ' ' THR . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.727 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.683 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.507 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.617 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 -103.64 140.01 38.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.585 ' O ' ' HD1' ' A' ' 119' ' ' PHE . 0.1 OUTLIER -90.58 109.95 21.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.21 179.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.39 118.98 24.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.744 0.307 . . . . 0.0 110.612 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 57.6 ttm -76.01 -40.08 54.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.759 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.26 7.06 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.796 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 81.9 t60 -66.65 -40.0 88.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.822 0.344 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 77.1 p -63.26 -39.78 95.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.568 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -23.25 50.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 40.6 m170 -66.76 -42.58 85.92 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.58 -43.84 98.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.571 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.58 -44.95 95.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.004 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.655 HG21 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.433 ' CD2' HD12 ' A' ' 136' ' ' LEU . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.444 HG22 ' O ' ' A' ' 130' ' ' LYS . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.672 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB3' HD13 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HB2' ' O ' ' A' ' 136' ' ' LEU . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.616 ' O ' HD12 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.694 HD22 HD12 ' A' ' 69' ' ' ILE . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.464 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -69.98 -29.29 66.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.437 HD21 ' HB2' ' A' ' 90' ' ' LYS . 83.9 mt -69.43 -25.88 64.34 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.809 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 95.1 mt -67.7 130.18 42.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 110.9 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.142 180.0 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.8 mtm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.862 0.363 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -39.88 75.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.875 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -74.05 147.39 42.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -85.83 129.44 54.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.097 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.18 149.92 88.23 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.562 2.175 . . . . 0.0 112.505 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -76.56 154.43 34.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.518 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 134.6 57.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.972 0.415 . . . . 0.0 110.797 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 t -81.59 133.68 35.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.572 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.98 135.72 24.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.518 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 m -73.65 129.31 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 121.116 0.484 . . . . 0.0 111.23 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -79.74 152.43 29.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.457 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -76.45 160.32 29.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.759 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.1 m -70.54 129.99 40.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.155 0.502 . . . . 0.0 111.132 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.85 -146.69 7.11 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.684 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.54 118.47 5.5 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.174 1.916 . . . . 0.0 111.566 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -81.55 26.68 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.7 t -77.84 113.4 16.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.852 0.358 . . . . 0.0 110.586 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.9 tp -78.56 118.48 20.72 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.803 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.478 ' HG3' ' CD1' ' A' ' 24' ' ' ILE . 86.1 tt0 -123.0 108.97 13.52 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.72 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m -92.16 149.77 21.29 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.479 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.72 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.651 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.453 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.511 HH12 ' HG2' ' A' ' 23' ' ' GLU . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.577 ' O ' HG21 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.577 HG21 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -65.93 -40.02 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 61.4 t80 -59.93 -41.07 91.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.77 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 66.9 tt0 -59.96 -39.99 87.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.103 0.477 . . . . 0.0 110.334 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.5 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 71.3 m -60.36 -38.12 82.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -60.2 -46.11 90.84 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.537 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 95.3 mttt -61.11 -38.29 85.81 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.97 -1.014 . . . . 0.0 108.848 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.5 ' HB3' ' O ' ' A' ' 37' ' ' SER . 86.5 tt0 -60.05 -40.42 89.34 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.616 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -60.31 -40.32 90.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 64.2 t -61.32 -42.3 93.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.677 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.04 87.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.769 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.638 ' O ' ' HG3' ' A' ' 47' ' ' GLN . 86.3 tt0 -59.47 -38.98 82.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.456 ' C ' ' H ' ' A' ' 47' ' ' GLN . 58.3 mtp180 -59.94 -38.8 83.47 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.88 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.42 28.1 0.17 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 114.539 0.576 . . . . 0.0 114.539 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 94.0 mt-30 -76.18 122.84 24.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 118.01 0.905 . . . . 0.0 110.276 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.606 ' HE3' ' HA ' ' A' ' 51' ' ' ASP . 55.3 pttt -86.63 114.36 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.177 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 49' ' ' LEU . 3.4 mm? -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.441 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.9 mt-10 -62.16 -39.99 94.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.064 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.606 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 95.6 m-20 65.77 109.18 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.339 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.8 m -69.29 149.95 47.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.144 0.497 . . . . 0.0 110.794 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.612 ' O ' HG21 ' A' ' 57' ' ' VAL . 91.2 m-85 -63.63 -23.21 67.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.889 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -59.97 -40.0 87.58 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.848 0.356 . . . . 0.0 111.004 -178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.725 HD21 ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt -60.82 -42.87 98.57 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.612 HG21 ' O ' ' A' ' 53' ' ' TYR . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.633 ' HZ ' HG22 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.725 ' HE3' HD21 ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.494 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.853 ' HB3' HD23 ' A' ' 136' ' ' LEU . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.606 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.782 HD13 HD13 ' A' ' 139' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.567 ' HA ' ' CG1' ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' A' ' 75' ' ' ILE . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.567 ' CG1' ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.485 HG21 ' N ' ' A' ' 76' ' ' LEU . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.624 HD13 ' HE2' ' A' ' 79' ' ' LYS . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.634 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.624 ' HE2' HD13 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m -62.1 -40.02 94.47 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -58.62 -49.96 75.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -89.93 -79.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.78 0.324 . . . . 0.0 111.465 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.1 p30 -171.62 158.65 4.71 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -85.69 65.31 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.603 2.202 . . . . 0.0 112.033 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.463 ' O ' ' HD2' ' A' ' 90' ' ' LYS . 40.2 m -81.72 135.11 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.823 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -76.69 127.65 33.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.786 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.589 HG13 ' H ' ' A' ' 90' ' ' LYS . 46.9 pt -154.52 157.58 4.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -59.96 -37.84 80.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.734 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.589 ' H ' HG13 ' A' ' 87' ' ' ILE . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.407 ' HB2' HD13 ' A' ' 154' ' ' LEU . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.432 ' HZ3' HD12 ' A' ' 75' ' ' ILE . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.616 ' CD2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 36.4 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 100' ' ' GLU . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.609 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.606 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.604 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.568 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.654 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' HD21 ' A' ' 107' ' ' LEU . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.654 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.618 ' HG3' ' HG3' ' A' ' 121' ' ' MET . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.455 ' HB3' ' CE1' ' A' ' 119' ' ' PHE . 79.2 mtp85 -100.97 101.89 12.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.455 ' CE1' ' HB3' ' A' ' 118' ' ' ARG . 1.7 p90 39.46 -90.14 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.743 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 118' ' ' ARG . 14.7 t -161.29 20.88 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.897 0.379 . . . . 0.0 110.732 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' MET . . . . . 0.618 ' HG3' ' HG3' ' A' ' 115' ' ' ARG . 99.6 mmm 49.33 178.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.753 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -87.3 156.86 28.62 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.602 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.455 ' HA ' ' ND1' ' A' ' 126' ' ' HIS . 29.2 p-80 -65.93 -40.2 91.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.2 p -75.21 -39.99 59.56 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 0.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -22.57 62.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.74 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.49 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 48.7 m170 -65.23 -43.92 89.92 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -60.72 -45.11 95.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.07 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -62.67 -45.71 91.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.468 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.633 HG22 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 126' ' ' HIS . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.621 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.47 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.853 HD23 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.782 HD13 HD13 ' A' ' 69' ' ' ILE . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.636 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.419 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.621 HD11 HG21 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.431 HD12 HD23 ' A' ' 76' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.616 HG22 ' CD2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.626 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.434 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.08 -28.53 67.44 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.407 HD13 ' HB2' ' A' ' 91' ' ' TYR . 0.7 OUTLIER -68.55 -22.25 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.135 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 87.4 mt -65.22 137.65 57.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 83.0 mtt85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.935 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 ttm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.901 0.382 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -40.05 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.0 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -75.83 130.56 38.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.167 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -85.6 149.4 51.42 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.004 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.38 139.46 59.62 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.57 2.18 . . . . 0.0 112.075 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -78.99 -6.91 57.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -93.57 120.01 33.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.748 0.308 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.0 m -80.01 132.32 35.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.09 119.97 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.602 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.629 ' CG1' ' HD2' ' A' ' 16' ' ' LYS . 21.5 t -84.7 119.16 33.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.465 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -81.56 131.16 35.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.1 m -77.82 126.99 31.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.394 . . . . 0.0 110.897 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -162.58 -26.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.34 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.62 -151.3 11.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.332 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.79 133.62 58.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.585 2.19 . . . . 0.0 112.133 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.629 ' HD2' ' CG1' ' A' ' 10' ' ' VAL . 61.4 pttt -159.98 60.27 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.182 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -77.65 130.48 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.64 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.7 mt -77.76 130.37 36.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.296 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -122.66 109.24 14.02 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 24' ' ' ILE . 7.4 m -84.66 156.57 21.46 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.579 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.477 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.416 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.766 ' O ' HD22 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 28' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.596 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 95.6 mtt-85 -66.02 -40.02 90.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.549 ' CZ ' ' HE3' ' A' ' 39' ' ' LYS . 64.8 t80 -58.3 -41.54 84.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.554 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.667 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.8 mt-30 -67.0 -40.06 87.27 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.539 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.474 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 66.1 p -61.3 -37.93 85.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.138 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.596 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 27.3 m-85 -60.97 -48.88 79.76 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' HE3' ' CZ ' ' A' ' 35' ' ' TYR . 97.7 mttt -62.37 -35.0 77.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.176 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.667 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.8 mt-10 -59.97 -42.46 94.18 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.633 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 37' ' ' SER . 1.7 mpt_? -66.45 -40.18 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 110.911 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -63.15 -43.29 98.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.667 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.98 -44.25 94.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.068 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.01 -44.37 94.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.056 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 73.2 mtt-85 -60.05 -39.96 87.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.2 105.46 1.3 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.522 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -80.19 121.08 25.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.826 0.346 . . . . 0.0 110.495 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.579 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 95.9 mttt -84.81 117.26 23.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.316 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.85 -42.49 70.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 13.3 pt-20 -178.77 106.21 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 111.148 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.579 ' OD2' ' HD3' ' A' ' 48' ' ' LYS . 97.8 m-20 -80.2 127.0 31.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.044 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.53 ' HG ' ' HB2' ' A' ' 54' ' ' HIS . 46.0 t -70.11 129.95 40.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.276 0.56 . . . . 0.0 111.549 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.622 ' O ' HG21 ' A' ' 57' ' ' VAL . 51.8 p90 -65.6 -17.9 64.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.446 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.53 ' HB2' ' HG ' ' A' ' 52' ' ' SER . 68.8 m-70 -56.2 -36.52 68.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.368 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.495 HD11 ' HZ3' ' A' ' 59' ' ' LYS . 3.1 tm? -59.78 -45.06 93.46 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.622 HG21 ' O ' ' A' ' 53' ' ' TYR . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.564 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.656 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.739 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.754 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.651 HG23 HD22 ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.739 ' HE3' ' HA ' ' A' ' 67' ' ' LYS . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.793 ' HD3' HD21 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.716 HG12 ' HA ' ' A' ' 70' ' ' MET . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.462 ' N ' HG11 ' A' ' 73' ' ' VAL . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.774 HD11 HD23 ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 72' ' ' LYS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.535 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.507 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.492 ' NZ ' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.535 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t -63.91 -44.76 91.96 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.507 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 70.4 m-85 -59.93 -39.97 87.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.058 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.544 ' HG3' ' HD2' ' A' ' 84' ' ' PRO . 52.1 tp10 -64.05 124.05 20.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.575 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 20.0 m-20 -59.99 -53.83 61.41 Favored Pre-proline 0 N--CA 1.462 0.153 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.393 -178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.575 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 77.2 Cg_exo -47.94 156.21 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.479 2.119 . . . . 0.0 112.76 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.6 p -82.66 -178.21 7.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.772 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' HD2' ' A' ' 90' ' ' LYS . 64.4 t30 -74.38 142.2 45.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.44 HG23 HD12 ' A' ' 87' ' ' ILE . 0.2 OUTLIER -154.52 -162.53 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.025 -179.115 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.594 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 -60.07 -39.96 87.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.676 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.621 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.594 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.62 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 92.6 m-70 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.793 HD21 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.679 ' HA ' ' CZ2' ' A' ' 68' ' ' TRP . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.66 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.765 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.765 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.801 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.801 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.69 ' HD2' HG23 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -106.48 -105.48 0.33 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -88.53 133.15 34.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.725 0.297 . . . . 0.0 110.802 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 t -157.21 27.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.011 0.434 . . . . 0.0 110.948 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 90.8 mmm -81.31 -36.07 30.22 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.767 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.3 110.24 3.02 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.442 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.537 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 50.6 p-80 -67.13 -40.06 86.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.35 . . . . 0.0 110.872 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.5 p -60.89 -40.06 91.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.627 ' O ' ' HG2' ' A' ' 128' ' ' GLU . . . -58.38 -24.06 58.87 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.567 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 76.0 m80 -68.06 -42.37 80.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.068 0.461 . . . . 0.0 110.166 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -43.63 95.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.218 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 125' ' ' ALA . 14.5 pt-20 -61.51 -43.61 98.55 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.84 -0.344 . . . . 0.0 111.031 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.69 HG23 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 133' ' ' ILE . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 130' ' ' LYS . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.625 HD12 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.577 ' O ' HD11 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.66 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.627 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HA ' HD13 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.444 ' O ' HD22 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.668 HD13 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.486 ' N ' HD23 ' A' ' 148' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.403 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.492 ' HD2' ' NZ ' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 -70.02 -20.63 63.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.464 ' HB3' ' O ' ' A' ' 151' ' ' GLY . 61.4 tp -68.98 -25.76 64.69 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.008 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.05 133.85 47.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.124 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.845 179.546 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.628 0.251 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 62.82 79.54 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.94 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -71.29 141.47 50.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.789 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.466 ' CZ ' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -85.9 132.67 43.26 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.379 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.552 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 61.4 Cg_endo -73.17 145.82 39.79 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.421 2.08 . . . . 0.0 112.203 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 61.3 mttm 79.22 179.95 0.11 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.939 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -86.08 126.79 34.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.673 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.466 HG21 ' CZ ' ' A' ' 4' ' ' PHE . 73.0 p -80.02 129.73 34.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.169 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 t -94.39 120.0 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.6 t -83.57 120.07 34.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.666 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -157.48 116.24 3.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.919 0.39 . . . . 0.0 111.251 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 t -158.04 100.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.736 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.33 26.39 13.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.893 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.85 109.74 3.37 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.675 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.5 164.66 12.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.555 2.17 . . . . 0.0 112.027 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -74.67 151.67 39.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.388 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.9 129.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.871 0.367 . . . . 0.0 110.576 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 118.41 19.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.086 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.624 ' HG2' ' CG1' ' A' ' 24' ' ' ILE . 56.6 tt0 -122.46 109.69 14.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.69 HG22 ' HG2' ' A' ' 22' ' ' GLU . 2.1 m -88.21 151.87 22.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.74 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.69 ' HG2' HG22 ' A' ' 20' ' ' THR . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.466 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.624 ' CG1' ' HG2' ' A' ' 19' ' ' GLU . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.496 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 62.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.401 ' O ' HG21 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.447 ' O ' ' HD2' ' A' ' 35' ' ' TYR . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -60.12 -46.67 88.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.447 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 72.0 m-85 -60.09 -45.45 92.87 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.243 0.544 . . . . 0.0 110.417 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.486 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 56.8 tt0 -65.99 -38.04 87.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.508 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 21.5 t -60.4 -40.02 89.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.271 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.92 -48.6 81.06 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.486 ' HE2' ' HA ' ' A' ' 36' ' ' GLN . 7.9 mtmm -62.18 -38.96 91.09 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 86.4 tt0 -60.01 -39.92 87.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.583 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 37' ' ' SER . 99.7 mtt180 -59.23 -40.05 84.65 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.784 -179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -60.01 -46.67 93.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.93 94.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.3 mt-10 -56.41 -25.85 51.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.329 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.456 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 106.92 10.76 27.7 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.219 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -77.74 114.46 16.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.456 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -91.05 114.32 26.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.2 tp -90.02 -80.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.076 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -71.68 -54.3 10.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.511 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -156.45 -164.24 1.62 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.88 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.7 m -69.49 130.29 42.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.087 0.47 . . . . 0.0 110.324 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.551 ' O ' HG23 ' A' ' 57' ' ' VAL . 64.7 t80 -59.74 -19.65 51.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.036 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.493 ' ND1' ' HD2' ' A' ' 118' ' ' ARG . 37.2 t-80 -59.41 -40.01 85.25 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.576 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp -60.11 -44.52 94.81 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.541 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 53' ' ' TYR . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.541 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.413 HD21 ' CZ3' ' A' ' 140' ' ' TRP . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.604 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.647 ' O ' HG11 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.631 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.578 ' HD2' ' CG ' ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.647 HG11 ' O ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.631 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.539 ' N ' ' OD1' ' A' ' 74' ' ' ASN . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.77 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.541 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.585 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.541 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t -60.49 -40.21 90.5 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.585 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 93.6 m-85 -59.75 -33.38 71.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.084 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 60.33 43.32 13.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.046 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -70.03 160.01 82.1 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.45 52.17 0.63 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.879 2.386 . . . . 0.0 112.439 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.4 t -85.95 155.73 20.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.867 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -76.73 142.59 40.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.471 HD11 ' HD2' ' A' ' 156' ' ' ARG . 85.5 mt -69.68 -39.91 78.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.997 -178.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.03 -40.04 87.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.79 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.447 ' HB2' HD21 ' A' ' 154' ' ' LEU . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.79 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.497 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.2 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 93' ' ' LYS . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.604 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 97' ' ' LEU . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.557 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.618 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.537 HD13 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.618 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' A' ' 107' ' ' LEU . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.676 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.411 ' HB2' ' CE2' ' A' ' 58' ' ' PHE . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.676 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.493 ' HD2' ' ND1' ' A' ' 54' ' ' HIS . 8.4 mtt-85 -105.64 140.08 39.25 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 60.09 96.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.88 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.2 t -79.32 168.23 19.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.659 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 68.0 mtt 63.67 100.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.917 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 165.97 70.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.444 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 45.3 p-80 -63.65 -40.06 95.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 0.0 110.778 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.4 m -61.15 -39.99 92.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.293 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.09 -24.68 59.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.013 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.28 -40.14 86.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.121 0.486 . . . . 0.0 109.86 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.0 -40.03 87.82 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.488 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -64.66 -43.36 93.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.412 ' O ' HD11 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.412 HD11 ' O ' ' A' ' 132' ' ' HIS . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.49 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.417 ' HA ' HD13 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.588 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.578 ' CG ' ' HD2' ' A' ' 72' ' ' LYS . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.878 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.878 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -69.71 -24.07 63.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.454 ' HB3' ' O ' ' A' ' 151' ' ' GLY . 69.0 tp -68.27 -25.97 65.43 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.846 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.09 130.15 39.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.707 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.471 ' HD2' HD11 ' A' ' 87' ' ' ILE . 78.7 mtp180 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.916 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mmm . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.828 0.347 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -79.95 -10.28 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.154 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.22 142.15 39.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.827 0.346 . . . . 0.0 110.868 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -85.98 116.98 67.85 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.434 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.38 133.31 34.38 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.441 2.094 . . . . 0.0 112.142 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -70.2 -40.0 74.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.777 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -103.24 125.59 49.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.966 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 t -80.11 128.85 33.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.604 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 m -88.86 117.35 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 CA-C-O 120.928 0.394 . . . . 0.0 111.068 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.8 t -84.2 126.0 40.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.167 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -78.59 129.19 34.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.594 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -160.95 120.73 2.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.276 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.1 p -157.81 9.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -90.06 -89.82 1.28 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.486 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.86 155.12 11.43 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.479 2.12 . . . . 0.0 112.311 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -75.85 143.56 41.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.01 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.7 m -75.37 133.74 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.977 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -75.68 121.58 22.71 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.678 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.671 ' HB3' HD13 ' A' ' 24' ' ' ILE . 99.2 mt-10 -121.77 110.85 16.42 Favored 'General case' 0 N--CA 1.419 -2.011 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.535 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER -80.79 158.1 25.55 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.643 -179.009 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.535 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.671 HD13 ' HB3' ' A' ' 19' ' ' GLU . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.562 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.656 ' O ' HG23 ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 28' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.435 HD13 ' HG2' ' A' ' 28' ' ' ARG . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.633 ' O ' ' HD2' ' A' ' 38' ' ' PHE . 95.4 mtt-85 -65.72 -40.3 92.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -59.67 -45.25 92.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.727 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -61.22 -42.26 98.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.058 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -39.99 92.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.865 0.364 . . . . 0.0 111.777 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.633 ' HD2' ' O ' ' A' ' 34' ' ' ARG . 48.4 m-85 -67.92 -45.61 73.88 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.01 -39.97 87.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.704 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.727 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.4 mt-10 -59.78 -43.97 94.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.1 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 mtp-105 -66.05 -40.02 90.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.844 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 38' ' ' PHE . 48.3 t -67.32 -42.25 87.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.71 -47.99 83.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.95 -45.06 93.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.481 ' O ' ' HG2' ' A' ' 121' ' ' MET . 59.9 ttt85 -60.3 -39.78 88.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.378 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 72.01 141.75 0.35 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.1 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -79.15 112.76 16.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.769 0.319 . . . . 0.0 110.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.558 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 58.5 tttp -89.4 136.95 32.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.214 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 84.7 mt -161.5 -64.67 0.06 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.701 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.8 mt-10 -65.63 -39.89 91.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.213 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.424 ' OD1' ' HE3' ' A' ' 48' ' ' LYS . 66.1 m-20 69.42 102.29 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.078 0.466 . . . . 0.0 110.202 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.9 p -69.81 148.35 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.58 -178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.69 ' O ' HG22 ' A' ' 57' ' ' VAL . 86.0 m-85 -69.91 -19.06 63.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.563 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.737 ' HB3' HH11 ' A' ' 118' ' ' ARG . 72.3 m80 -55.46 -38.63 69.3 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.631 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.626 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -60.44 -43.09 97.16 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.025 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.69 HG22 ' O ' ' A' ' 53' ' ' TYR . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.727 ' CE1' HD13 ' A' ' 111' ' ' LEU . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.553 ' HB2' ' NE2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.849 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.815 ' O ' HG21 ' A' ' 73' ' ' VAL . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.452 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.884 ' HD2' HD13 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.815 HG21 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.989 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 1.022 HD23 HD13 ' A' ' 146' ' ' LEU . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.758 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.834 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.758 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m -60.71 -40.05 90.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.583 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 91.0 m-85 -58.74 -41.63 86.91 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.433 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.952 ' HG3' ' HD3' ' A' ' 84' ' ' PRO . 51.2 tp10 -140.08 128.59 22.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.957 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.57 68.17 81.18 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.851 0.358 . . . . 0.0 111.501 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.952 ' HD3' ' HG3' ' A' ' 82' ' ' GLU . 86.7 Cg_endo -85.17 179.4 4.13 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.943 2.429 . . . . 0.0 111.72 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.3 m -79.91 -70.41 0.52 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.471 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.602 ' C ' HG13 ' A' ' 87' ' ' ILE . 98.1 m-20 -78.12 128.47 33.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.578 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.935 HG22 ' HB2' ' A' ' 90' ' ' LYS . 18.8 mt -154.81 87.3 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.881 0.372 . . . . 0.0 111.32 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.468 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 -61.15 -40.03 92.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.907 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.935 ' HB2' HG22 ' A' ' 87' ' ' ILE . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.989 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.699 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.697 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 98.1 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.884 HD13 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.861 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.849 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.687 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.861 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.456 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.687 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.727 HD13 ' CE1' ' A' ' 58' ' ' PHE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.435 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.532 ' O ' ' HB ' ' A' ' 120' ' ' THR . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.737 HH11 ' HB3' ' A' ' 54' ' ' HIS . 85.1 mtt-85 -81.28 -169.28 2.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.719 ' O ' HG22 ' A' ' 120' ' ' THR . 87.2 m-85 -70.1 -38.8 75.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.559 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 119' ' ' PHE . 7.6 t 48.59 34.67 5.17 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.832 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 73.8 mtm -84.21 133.14 34.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.714 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 118.52 106.55 2.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.872 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.514 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 52.7 p-80 -64.63 -40.04 94.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.565 0.221 . . . . 0.0 111.289 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.4 p -69.6 -39.97 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.903 0.383 . . . . 0.0 110.268 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.87 -23.08 63.14 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.544 ' O ' HG21 ' A' ' 129' ' ' THR . 56.3 t-80 -66.15 -45.1 82.18 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.043 179.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.36 -43.38 97.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.307 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -62.35 -46.71 87.44 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.518 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.544 HG21 ' O ' ' A' ' 126' ' ' HIS . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.59 ' O ' HG23 ' A' ' 133' ' ' ILE . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.553 ' NE2' ' HB2' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.59 HG23 ' O ' ' A' ' 130' ' ' LYS . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.547 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.547 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.496 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.661 ' CD1' HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 1.022 HD13 HD23 ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.72 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.476 ' HA2' ' HB2' ' A' ' 154' ' ' LEU . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -70.05 -25.35 63.51 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.476 ' HB2' ' HA2' ' A' ' 151' ' ' GLY . 3.4 mm? -68.68 -24.94 64.57 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.947 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.25 137.41 56.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.947 -179.97 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.916 0.389 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 59.29 -175.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.993 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -75.58 149.94 38.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.997 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -85.07 151.15 56.74 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.825 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.36 137.35 73.93 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.485 2.123 . . . . 0.0 112.159 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -161.56 160.06 28.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.13 142.55 57.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.737 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -76.96 134.86 38.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.275 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.6 m -84.92 135.36 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.562 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.485 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 16.1 m -77.25 139.65 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.289 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 10' ' ' VAL . 47.4 mt-10 71.32 141.32 0.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.005 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 4.1 m 68.34 20.36 8.69 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.305 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.3 t -79.97 -8.45 59.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.248 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.557 ' N ' ' HD2' ' A' ' 15' ' ' PRO . . . 159.93 -51.12 0.37 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.573 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 14' ' ' GLY . 21.4 Cg_endo -60.8 156.13 45.03 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.363 2.042 . . . . 0.0 112.189 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -78.02 123.44 26.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.804 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.7 t -82.15 113.89 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.428 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -80.02 125.65 30.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.686 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -122.41 109.44 14.4 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.777 0.798 . . . . 0.0 108.932 177.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.651 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.9 m -91.95 152.47 20.01 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.801 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.604 ' O ' HG22 ' A' ' 24' ' ' ILE . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 20' ' ' THR . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.651 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 21' ' ' ALA . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.658 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.636 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.47 ' CG ' ' HE2' ' A' ' 38' ' ' PHE . 60.2 ttp180 -62.39 -41.37 98.6 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.464 ' CD1' HG13 ' A' ' 31' ' ' VAL . 4.2 m-85 -59.99 -41.53 92.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.9 -40.0 93.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.86 0.362 . . . . 0.0 110.709 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.2 m -62.43 -39.98 95.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.312 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.47 ' HE2' ' CG ' ' A' ' 34' ' ' ARG . 40.0 m-85 -65.79 -48.55 71.38 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -60.42 -39.97 89.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.606 177.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -44.54 94.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.871 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 32.6 ttt85 -63.19 -40.05 96.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.872 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 66.1 t -69.23 -43.93 81.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -46.91 87.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.617 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.616 ' HA ' ' CE ' ' A' ' 48' ' ' LYS . 14.1 pt-20 -60.08 -40.36 89.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.558 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 29.4 mmt85 -60.06 -39.98 87.9 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.029 0.442 . . . . 0.0 110.814 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -98.09 -170.11 32.2 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.949 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 5.4 pm0 -76.31 119.04 19.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.142 0.496 . . . . 0.0 110.406 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.616 ' CE ' ' HA ' ' A' ' 44' ' ' GLU . 55.7 mttt -81.78 144.27 31.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.909 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.507 ' H ' HD12 ' A' ' 49' ' ' LEU . 7.1 mp -70.11 -35.13 73.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.407 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.34 -37.16 84.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.882 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -79.56 143.1 35.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.855 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.2 t -69.57 163.98 24.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.035 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.721 ' O ' HG22 ' A' ' 57' ' ' VAL . 96.0 m-85 -60.03 -32.37 70.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.456 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.472 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 77.2 m80 -59.44 -39.59 84.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.7 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.478 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 7.8 tt -60.0 -44.15 94.72 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 53' ' ' TYR . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.569 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.639 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HB3' ' O ' ' A' ' 62' ' ' ALA . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.742 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.673 ' O ' HG13 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.409 ' O ' HG21 ' A' ' 75' ' ' ILE . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.649 ' HB3' HD12 ' A' ' 143' ' ' LEU . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.643 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.431 ' CD2' HD12 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.615 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t -62.95 -40.11 96.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.689 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 68.1 t80 -58.84 -49.82 76.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.091 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.689 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 96.5 mt-10 -126.03 -87.4 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.844 0.354 . . . . 0.0 110.779 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -151.41 150.66 27.38 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.257 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 27.2 Cg_exo -61.13 -175.56 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.035 1.823 . . . . 0.0 111.682 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 1.4 p -81.75 138.26 35.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.269 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -78.43 129.19 34.64 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.71 HG13 ' H ' ' A' ' 88' ' ' GLN . 8.8 pt 36.5 -86.73 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.71 ' H ' HG13 ' A' ' 87' ' ' ILE . 77.8 mt-30 -59.96 -39.98 87.46 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.607 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.922 ' HD2' HD23 ' A' ' 154' ' ' LEU . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.481 ' CZ ' HD21 ' A' ' 154' ' ' LEU . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.582 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.524 ' CD2' HG21 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.634 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.726 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.742 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.725 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.589 HD11 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.725 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.442 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.569 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.491 ' HG3' ' CD2' ' A' ' 119' ' ' PHE . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.48 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 -106.18 -30.92 8.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.491 ' CD2' ' HG3' ' A' ' 115' ' ' ARG . 78.0 m-85 -92.08 139.97 30.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.971 0.415 . . . . 0.0 111.094 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 15.2 t -157.0 28.26 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.728 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 27.0 ttt -152.11 -36.28 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.04 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -78.78 93.35 1.27 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.577 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 75.5 m80 -68.27 -39.96 82.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.9 p -60.76 -39.89 90.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.046 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.29 -25.31 47.97 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.45 -41.97 83.86 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.89 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.59 -41.97 95.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.017 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -62.68 -41.08 98.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.67 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.57 ' CD2' HD13 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.57 HD13 ' CD2' ' A' ' 132' ' ' HIS . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.475 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 72' ' ' LYS . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.736 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.736 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.96 -21.16 63.28 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.922 HD23 ' HD2' ' A' ' 90' ' ' LYS . 56.6 tp -68.31 -26.04 65.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.164 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.4 137.39 52.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.594 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.86 -179.762 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.612 0.244 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -79.99 -9.96 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.229 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -74.53 137.57 42.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.839 0.352 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -85.47 140.24 36.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.09 135.49 47.61 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.161 . . . . 0.0 112.141 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -80.01 -9.92 59.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -94.83 135.17 36.65 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.872 0.368 . . . . 0.0 110.606 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 70.6 p -79.53 132.97 36.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 p -91.35 119.92 39.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.143 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.6 t -80.83 127.19 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.92 0.391 . . . . 0.0 110.729 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.74 ' HB3' ' HD3' ' A' ' 15' ' ' PRO . 84.3 tt0 -79.12 132.1 36.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -78.72 130.0 35.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.068 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.94 35.41 21.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.705 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -131.88 -82.26 0.23 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.224 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.74 ' HD3' ' HB3' ' A' ' 11' ' ' GLU . 98.4 Cg_endo -80.16 138.76 12.93 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.434 2.756 . . . . 0.0 112.98 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm 60.14 39.94 18.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.258 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 14' ' ' GLY . 39.5 t -80.16 116.91 25.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 tt -80.07 106.09 11.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB2' ' CD1' ' A' ' 24' ' ' ILE . 14.4 pt-20 -123.89 109.66 13.88 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.705 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -87.25 149.72 24.39 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.067 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.43 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.705 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.574 ' CD1' ' HB2' ' A' ' 19' ' ' GLU . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.519 ' O ' HG22 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 69.8 mtt180 -62.39 -40.54 96.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.485 ' CE2' HG12 ' A' ' 31' ' ' VAL . 41.8 m-85 -59.96 -40.66 89.81 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.883 0.373 . . . . 0.0 110.907 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -67.23 -40.0 86.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.6 t -62.95 -39.95 96.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.169 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 52.0 m-85 -65.73 -47.56 74.89 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -61.67 -38.12 86.59 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.599 177.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -42.65 94.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.18 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -62.1 -40.45 95.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 66.4 t -65.68 -40.35 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.25 -43.91 95.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.514 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.03 -48.19 82.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.735 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -59.91 -40.13 87.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.802 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.61 -178.32 45.25 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.851 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -76.39 115.93 16.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.007 0.432 . . . . 0.0 110.781 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -81.84 154.61 25.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.175 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.569 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 84.6 mt -155.4 -43.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.569 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 79.5 106.39 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.442 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -80.02 148.3 31.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.198 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.491 ' HG ' ' NH2' ' A' ' 118' ' ' ARG . 82.8 p -69.79 153.21 43.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 111.004 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.505 ' O ' HG22 ' A' ' 57' ' ' VAL . 94.0 m-85 -66.85 -22.7 65.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.452 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.611 ' HA ' HG21 ' A' ' 57' ' ' VAL . 75.9 m80 -60.05 -40.02 87.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.559 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.06 -45.26 93.45 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.518 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.611 HG21 ' HA ' ' A' ' 54' ' ' HIS . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HZ ' HG22 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HB3' ' CE1' ' A' ' 132' ' ' HIS . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.726 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.638 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.507 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.726 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.521 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.772 ' O ' HG12 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.682 ' HA ' HG23 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.772 HG12 ' O ' ' A' ' 69' ' ' ILE . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.428 ' N ' HG22 ' A' ' 73' ' ' VAL . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.714 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.801 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.621 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m -63.9 -46.22 85.82 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.0 -48.54 81.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.123 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -134.14 143.32 47.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.595 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.0 129.39 92.26 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.223 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.28 -166.14 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.458 2.106 . . . . 0.0 112.229 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.732 ' HB ' ' HA3' ' A' ' 89' ' ' GLY . 36.9 m -81.31 138.3 35.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.163 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -76.58 121.23 22.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.197 0.522 . . . . 0.0 111.298 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.716 ' HA ' HD11 ' A' ' 154' ' ' LEU . 78.6 mt 70.79 -62.8 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.855 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.927 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 -60.11 -41.65 93.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.053 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.732 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.816 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.927 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.629 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.727 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.68 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.799 HD22 ' HG3' ' A' ' 72' ' ' LYS . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.68 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.521 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.695 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.654 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.643 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 58' ' ' PHE . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.675 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.436 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.805 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.491 ' NH2' ' HG ' ' A' ' 52' ' ' SER . 20.8 ttm-85 -99.96 140.05 34.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . 0.596 ' O ' HG23 ' A' ' 120' ' ' THR . 47.5 p90 -76.58 -20.39 56.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.411 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.629 HG21 ' CZ ' ' A' ' 115' ' ' ARG . 12.7 t 43.28 -171.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.907 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 98.4 mmm -150.68 159.99 44.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.33 123.76 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.498 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.507 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 85.6 t60 -62.96 -41.34 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.835 0.35 . . . . 0.0 110.432 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 57.1 m -60.14 -39.96 88.14 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.71 -24.25 48.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.566 ' HA ' ' NH2' ' A' ' 115' ' ' ARG . 58.3 t-80 -66.16 -42.4 89.06 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.763 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.18 -40.56 94.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.556 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -60.86 -42.56 98.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.275 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.805 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.502 ' O ' HD12 ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.702 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.413 ' O ' HD22 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.634 HD23 ' N ' ' A' ' 139' ' ' LEU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.695 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' HD11 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.735 HD11 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.609 ' CD2' HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.703 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.78 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.816 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -70.03 -19.95 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.716 HD11 ' HA ' ' A' ' 87' ' ' ILE . 32.3 tp -67.88 -25.58 65.58 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.022 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.469 ' H ' HD11 ' A' ' 155' ' ' LEU . 8.7 mp -69.11 137.03 53.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.369 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.85 -179.835 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.6 mtm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 59.95 37.07 21.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -76.1 142.79 41.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.685 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -85.98 117.93 69.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.758 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.5 135.7 50.85 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.465 2.11 . . . . 0.0 112.15 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -76.79 129.98 37.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.653 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -99.52 131.96 45.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.735 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 60.7 m -78.98 130.0 35.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.906 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 32.6 t -91.24 129.02 42.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.13 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.7 m -77.21 138.56 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.879 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -83.27 24.42 0.81 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -70.57 -40.02 73.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.5 m -73.46 133.0 43.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.218 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -88.7 132.14 11.07 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.594 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.416 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 36.2 Cg_endo -65.0 144.58 82.93 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.729 2.286 . . . . 0.0 112.371 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 97.9 mttt -158.41 120.07 3.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 17' ' ' VAL . 12.4 p -77.83 133.22 30.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.173 0.511 . . . . 0.0 111.679 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.444 HD13 ' OE1' ' A' ' 23' ' ' GLU . 0.5 OUTLIER -76.28 127.5 33.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.09 -179.811 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.808 ' HG3' HD13 ' A' ' 24' ' ' ILE . 86.2 tt0 -122.42 109.72 14.74 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.726 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m -115.84 148.07 40.34 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.032 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.653 ' HG2' HG23 ' A' ' 20' ' ' THR . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.726 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.808 HD13 ' HG3' ' A' ' 19' ' ' GLU . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.655 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.655 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.403 ' O ' HG22 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.424 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 -65.95 -39.91 90.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.68 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 65.2 t80 -59.92 -49.54 77.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.202 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 72.4 tp60 -63.12 -39.97 96.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.059 0.457 . . . . 0.0 110.77 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.6 t -61.23 -39.85 91.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.93 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.67 -50.22 74.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.68 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 23.2 mttm -62.87 -38.19 89.89 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.946 176.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.96 -41.9 92.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.703 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.23 -40.07 94.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.978 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.77 -41.76 90.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.809 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.42 -42.48 96.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.06 -44.53 94.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.923 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.2 ttt180 -59.96 -40.08 87.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.13 148.04 17.08 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.231 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -78.75 116.95 19.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.81 0.338 . . . . 0.0 110.703 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -89.46 118.99 29.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.454 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.496 ' HG ' ' HB2' ' A' ' 51' ' ' ASP . 46.2 tp -70.01 -40.04 75.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.957 0.408 . . . . 0.0 110.914 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 46.47 17.63 0.05 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.496 ' HB2' ' HG ' ' A' ' 49' ' ' LEU . 98.9 m-20 -90.32 -73.05 0.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.954 0.407 . . . . 0.0 111.253 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.1 p -70.0 134.39 48.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.247 0.546 . . . . 0.0 111.346 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -65.66 -19.0 65.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.993 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.529 ' HA ' HG23 ' A' ' 57' ' ' VAL . 76.7 m80 -60.02 -38.63 83.24 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.049 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.95 -44.97 94.06 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 54' ' ' HIS . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.585 ' HZ ' HG22 ' A' ' 129' ' ' THR . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.647 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.552 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.712 ' HA ' ' CE ' ' A' ' 104' ' ' LYS . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.68 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.906 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.836 ' O ' HG21 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.756 ' HG2' ' O ' ' A' ' 69' ' ' ILE . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.642 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.6 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t -60.7 -41.16 94.63 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.414 ' HB3' ' OD2' ' A' ' 83' ' ' ASP . 66.2 m-85 -60.03 -39.99 87.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.699 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 62.06 19.97 11.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.108 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.593 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 4.5 m-20 -71.2 -59.2 3.46 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.572 0.225 . . . . 0.0 110.668 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 94.5 Cg_endo -82.98 151.84 14.27 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.688 2.259 . . . . 0.0 112.262 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.5 m -83.21 122.02 27.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.852 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.665 ' O ' HG21 ' A' ' 87' ' ' ILE . 47.9 p-10 -76.67 153.94 34.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.359 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.665 HG21 ' O ' ' A' ' 86' ' ' ASN . 36.0 pt -155.08 -162.02 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.74 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.581 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 -59.93 -40.08 87.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.096 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.578 ' HE2' ' NZ ' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.602 ' CD1' HD11 ' A' ' 154' ' ' LEU . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.642 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 100' ' ' GLU . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.651 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.68 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.549 HG22 ' CZ2' ' A' ' 68' ' ' TRP . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.712 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.672 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.672 ' HB3' ' O ' ' A' ' 105' ' ' SER . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' A' ' 107' ' ' LEU . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.432 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.413 ' HD3' ' CD2' ' A' ' 126' ' ' HIS . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.432 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.432 ' HD2' ' CB ' ' A' ' 54' ' ' HIS . 64.6 mtp85 -87.7 -171.45 3.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -77.91 133.82 38.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.857 0.361 . . . . 0.0 110.069 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.91 118.72 21.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.64 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 67.5 mtt -153.04 159.57 42.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.398 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 59.33 86.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.269 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 92.2 m-70 -63.3 -39.94 95.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.737 0.303 . . . . 0.0 111.078 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.7 t -59.94 -40.0 87.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.736 0.303 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.25 -23.84 57.39 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . 0.598 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 60.6 m170 -67.25 -42.49 83.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.841 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -59.96 -42.34 93.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.625 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -60.57 -47.88 84.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.851 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.585 HG22 ' HZ ' ' A' ' 58' ' ' PHE . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.757 ' O ' HD11 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.505 HD12 ' HG3' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.705 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.757 HD11 ' O ' ' A' ' 132' ' ' HIS . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.705 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.529 HD23 HG22 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' TRP . . . . . 0.632 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.768 HD11 HG23 ' A' ' 69' ' ' ILE . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.699 HD13 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.578 ' NZ ' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.7 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -68.5 -32.21 72.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.602 HD11 ' CD1' ' A' ' 91' ' ' TYR . 84.2 mt -69.29 -24.86 64.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.496 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 91.1 mt -62.8 132.45 52.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.912 0.387 . . . . 0.0 110.904 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.926 179.787 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 121.196 0.522 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 20' ' ' THR . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.602 ' O ' HG23 ' A' ' 31' ' ' VAL . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 27' ' ' ARG . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.57 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER . . . . . 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.815 ' CZ ' HG23 ' A' ' 129' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.038 ' HG ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.981 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.669 HD13 HD23 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.704 ' HA ' HG12 ' A' ' 73' ' ' VAL . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.935 ' HG2' HD22 ' A' ' 97' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.715 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.414 ' N ' HG13 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.844 HD11 ' HD3' ' A' ' 93' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.715 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.619 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.619 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.844 ' HD3' HD11 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.752 ' CE1' HG22 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.678 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.935 HD22 ' HG2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.678 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 97' ' ' LEU . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.94 ' HE3' HD22 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.743 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.636 HD12 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.623 HD21 ' CB ' ' A' ' 61' ' ' ASP . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.654 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.574 HG21 ' HB2' ' A' ' 58' ' ' PHE . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.631 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.57 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 . . . . . 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.815 HG23 ' CZ ' ' A' ' 58' ' ' PHE . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.631 ' HE3' ' HD2' ' A' ' 115' ' ' ARG . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.466 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.038 HD13 ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.637 ' CD1' HD11 ' A' ' 69' ' ' ILE . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.91 HD21 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.597 HD13 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.752 HG22 ' CE1' ' A' ' 94' ' ' HIS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 . . . . . 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 C--O 1.223 -0.309 0 CA-C-O 120.787 0.327 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.631 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.752 HG22 HH21 ' A' ' 27' ' ' ARG . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.752 HH21 HG22 ' A' ' 24' ' ' ILE . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 ttp85 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 55' ' ' LEU . 2.8 tm? . . . . . 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 115' ' ' ARG . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.009 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.757 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.77 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.51 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.785 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 93' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 146' ' ' LEU . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 73' ' ' VAL . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 150' ' ' LYS . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.639 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.692 ' HE2' HD12 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.798 ' HA ' HD12 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.671 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.671 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.714 HG22 ' HH2' ' A' ' 68' ' ' TRP . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' GLU . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 1.009 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.759 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.838 ' HG3' HD11 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.762 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.762 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.761 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.761 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.442 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.838 HD11 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.902 HD13 HD23 ' A' ' 65' ' ' LEU . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.56 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.755 ' HA ' HD12 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.807 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.493 ' O ' HG13 ' A' ' 24' ' ' ILE . 17.2 m . . . . . 0 C--O 1.223 -0.3 0 CA-C-O 121.139 0.495 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.417 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.649 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.683 ' O ' HG23 ' A' ' 31' ' ' VAL . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.649 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 27' ' ' ARG . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp . . . . . 0 CA--C 1.512 -0.49 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.457 HG23 ' N ' ' A' ' 58' ' ' PHE . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.553 ' HZ ' HG23 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.734 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.728 HD12 HD13 ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.864 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 140' ' ' TRP . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.621 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.683 ' HE2' HD23 ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' N ' HG13 ' A' ' 73' ' ' VAL . 21.0 m-80 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.652 HD11 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 146' ' ' LEU . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.444 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 64.0 tt0 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.474 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.666 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.592 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 30.9 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.799 ' O ' HD13 ' A' ' 97' ' ' LEU . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.666 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.799 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.685 ' O ' HG22 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.864 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLN . . . . . 0.5 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.708 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.742 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.686 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.686 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.829 0.347 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.553 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.734 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.709 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.728 HD13 HD12 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.709 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.71 ' CD1' HD11 ' A' ' 69' ' ' ILE . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.609 ' O ' HD13 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.645 HD21 ' HD2' ' A' ' 72' ' ' LYS . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.561 HD22 ' HZ3' ' A' ' 140' ' ' TRP . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 76' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.667 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.474 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.73 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m . . . . . 0 C--O 1.226 -0.132 0 CA-C-O 121.15 0.5 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.73 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.666 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.467 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.65 ' O ' HG23 ' A' ' 31' ' ' VAL . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 27' ' ' ARG . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD2' ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.62 ' HZ ' HG23 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HE3' ' CD2' ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 1.013 ' HA ' HD12 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.013 HD12 ' HA ' ' A' ' 62' ' ' ALA . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.628 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.937 HG23 HD11 ' A' ' 143' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.593 ' HA ' HG12 ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE2' HD13 ' A' ' 97' ' ' LEU . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.593 HG12 ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.585 HD21 HD12 ' A' ' 146' ' ' LEU . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HE2' HD12 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.638 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m . . . . . 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.609 ' NE2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 80.7 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.708 ' O ' HG23 ' A' ' 101' ' ' VAL . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.63 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . 0.507 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.644 ' HA ' ' OG1' ' A' ' 103' ' ' THR . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 97' ' ' LEU . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.644 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.576 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.658 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.445 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.793 0.33 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.62 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.689 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.471 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.01 HD21 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.651 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.794 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.937 HD11 HG23 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 142' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.609 HG22 ' NE2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.618 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.4 m . . . . . 0 C--O 1.225 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.487 ' HA ' HG22 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.489 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.618 HG22 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.489 ' N ' HG23 ' A' ' 24' ' ' ILE . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 31' ' ' VAL . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.804 ' O ' HD23 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 27' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 3.1 tm? . . . . . 0 CA--C 1.518 -0.261 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.0 HD22 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.768 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.52 HG23 ' CD2' ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.654 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.906 ' HD3' HD23 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.691 ' HA ' HD12 ' A' ' 76' ' ' LEU . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.681 HG21 ' CD2' ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 72' ' ' LYS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.558 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.533 ' HZ3' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t . . . . . 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.595 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 . . . . . 0 C--O 1.228 -0.077 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.742 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.635 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 52.0 m80 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.638 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.906 HD23 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.638 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 97' ' ' LEU . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 1.0 ' HE3' HD22 ' A' ' 65' ' ' LEU . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.779 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.622 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.779 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 114' ' ' THR . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.829 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.829 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.705 ' HD2' HG21 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 . . . . . 0 C--O 1.23 0.037 0 CA-C-O 120.738 0.304 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.705 HG21 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 111' ' ' LEU . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.78 HD13 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.675 ' NE1' HG13 ' A' ' 101' ' ' VAL . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.677 ' HA ' HD12 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.679 ' O ' HD23 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.677 HD12 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.679 HD23 ' O ' ' A' ' 144' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.533 ' HD2' ' HZ3' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.58 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.1 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.492 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.58 HG13 ' O ' ' A' ' 20' ' ' THR . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 7.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.412 ' O ' HG23 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 25' ' ' GLN . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.688 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.898 HD22 HD23 ' A' ' 136' ' ' LEU . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.676 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.733 HG23 HD22 ' A' ' 143' ' ' LEU . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.701 ' HA ' HG12 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.635 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.648 ' HD2' HD21 ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.701 HG12 ' HA ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.635 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.766 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.781 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.781 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t . . . . . 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.81 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.81 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 29.5 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HG23 ' A' ' 101' ' ' VAL . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.642 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.676 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.798 HG13 ' HE1' ' A' ' 140' ' ' TRP . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.833 ' HD3' HD12 ' A' ' 107' ' ' LEU . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.627 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 133' ' ' ILE . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.685 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.597 ' HG2' HG21 ' A' ' 129' ' ' THR . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 8.4 mtt-85 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.597 HG21 ' HG2' ' A' ' 115' ' ' ARG . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.556 ' O ' HD13 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 111' ' ' LEU . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.898 HD23 HD22 ' A' ' 65' ' ' LEU . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.798 ' HE1' HG13 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.453 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.733 HD22 HG23 ' A' ' 69' ' ' ILE . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.717 HD21 HG11 ' A' ' 101' ' ' VAL . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 143' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.914 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.914 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.658 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.183 0.516 . . . . 0.0 111.643 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.658 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 20' ' ' THR . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.59 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.739 ' O ' HG22 ' A' ' 31' ' ' VAL . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.6 ' HA ' ' CG2' ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 27' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.498 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.562 ' HB2' ' NE ' ' A' ' 118' ' ' ARG . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.415 ' N ' ' O ' ' A' ' 56' ' ' GLN . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.889 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.452 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.644 HD12 HD13 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.862 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.94 HG23 HD11 ' A' ' 143' ' ' LEU . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.459 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.902 ' HD2' HD11 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 1.123 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.853 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.757 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.853 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.465 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.814 ' HA ' ' HE2' ' A' ' 93' ' ' LYS . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 1.123 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.741 ' CE1' HG22 ' A' ' 147' ' ' THR . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.705 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 28.3 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.902 HD11 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.889 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.862 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.889 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.47 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.709 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.683 HD23 HD12 ' A' ' 133' ' ' ILE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.461 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.562 ' NE ' ' HB2' ' A' ' 58' ' ' PHE . 85.1 mtt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.764 0.316 . . . . 0.0 111.518 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.422 ' HG1' ' HE2' ' A' ' 58' ' ' PHE . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 135' ' ' GLU . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.889 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.683 HD12 HD23 ' A' ' 111' ' ' LEU . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.644 HD13 HD12 ' A' ' 65' ' ' LEU . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.47 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.73 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.94 HD11 HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.685 HD21 HG11 ' A' ' 101' ' ' VAL . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.744 HD13 ' CD2' ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.751 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.751 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.7 ' O ' HG22 ' A' ' 24' ' ' ILE . 2.9 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.86 0.362 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 25' ' ' GLN . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.529 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.657 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.7 HG22 ' O ' ' A' ' 20' ' ' THR . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.648 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 7.8 tt . . . . . 0 CA--C 1.517 -0.308 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.521 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.628 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.659 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.655 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.848 HD23 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.783 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.747 ' HA ' HG12 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.631 ' HD2' ' O ' ' A' ' 68' ' ' TRP . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.747 HG12 ' HA ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.668 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.445 ' CD2' HD13 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.641 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.668 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.561 ' HZ1' ' HG3' ' A' ' 150' ' ' LYS . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.707 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.592 ' CD2' HG22 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 101' ' ' VAL . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.657 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.783 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.766 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.739 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.62 HD12 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.739 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.575 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 . . . . . 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.635 0.255 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.658 ' NE2' HD11 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.488 HG23 ' HE2' ' A' ' 108' ' ' MET . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.848 HD13 HD23 ' A' ' 65' ' ' LEU . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.504 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 146' ' ' LEU . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.552 HD21 HG11 ' A' ' 101' ' ' VAL . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.77 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.422 ' HA2' ' NZ ' ' A' ' 90' ' ' LYS . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.718 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 121.337 0.589 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.718 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 20' ' ' THR . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.678 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.831 ' O ' HG23 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp . . . . . 0 CA--C 1.515 -0.399 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.617 ' HZ ' HG23 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.732 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.514 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.732 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.54 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.789 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.78 ' O ' HG22 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.825 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 76' ' ' LEU . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.987 HD13 HD23 ' A' ' 146' ' ' LEU . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.62 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.818 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.62 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m . . . . . 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.953 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 93' ' ' LYS . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.864 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.953 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.665 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.759 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.841 ' O ' HG23 ' A' ' 101' ' ' VAL . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.54 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 97' ' ' LEU . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.709 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.664 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.663 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.446 HD22 HD22 ' A' ' 65' ' ' LEU . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.679 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.44 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.812 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.679 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.8 ttm-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 . . . . . 0 CA--C 1.523 -0.069 0 CA-C-O 120.57 0.224 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.812 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.411 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.851 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.698 ' O ' HD23 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.709 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.651 ' O ' HD13 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.779 HD13 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.709 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.987 HD23 HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.74 HG22 ' CD2' ' A' ' 94' ' ' HIS . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.709 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.826 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLY . . . . . 0.864 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m . . . . . 0 N--CA 1.46 0.056 0 CA-C-O 121.293 0.568 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.727 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 20' ' ' THR . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.678 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.781 ' O ' HG23 ' A' ' 31' ' ' VAL . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.678 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.46 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.46 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.57 ' HA ' ' OD2' ' A' ' 61' ' ' ASP . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.575 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.744 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.916 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.773 ' O ' HG22 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.908 ' HD3' HD13 ' A' ' 143' ' ' LEU . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.916 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.627 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.627 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t . . . . . 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.465 0.174 . . . . 0.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HE2' ' HZ1' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' NE2' ' A' ' 95' ' ' GLN . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.809 ' O ' HG23 ' A' ' 101' ' ' VAL . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.673 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.744 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 97' ' ' LEU . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.745 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.692 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.746 ' CG ' HD11 ' A' ' 133' ' ' ILE . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 133' ' ' ILE . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.783 ' O ' HD13 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.746 HD11 ' CG ' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.739 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 65' ' ' LEU . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.739 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' TRP . . . . . 0.645 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.908 HD13 ' HD3' ' A' ' 72' ' ' LYS . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.457 HD21 HG11 ' A' ' 101' ' ' VAL . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.685 ' HZ1' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.815 0.341 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -70.02 -35.85 74.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -72.8 147.43 45.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.405 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 65.6 t80 -85.67 128.69 57.78 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 4' ' ' PHE . 10.6 Cg_exo -71.05 133.91 24.19 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.685 2.257 . . . . 0.0 112.349 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.74 139.98 42.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -98.08 120.02 37.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.889 0.376 . . . . 0.0 110.804 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.5 m -81.04 129.59 34.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.75 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' ' HB2' ' A' ' 12' ' ' SER . 18.8 t -91.89 128.25 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.448 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.7 t -78.87 127.34 39.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 111.856 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 60.04 27.25 16.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.449 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 9' ' ' VAL . 17.2 t -73.96 -42.07 61.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.502 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.8 m -78.27 -7.11 56.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.146 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.04 76.56 0.41 Allowed Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.031 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.92 126.37 11.85 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.597 2.198 . . . . 0.0 111.593 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 15.0 ttmt -80.05 100.63 8.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.142 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -80.45 131.81 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.718 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.6 mt -77.65 108.95 11.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 111.11 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' HD11 ' A' ' 24' ' ' ILE . 99.7 mt-10 -122.78 110.04 14.97 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m -82.69 158.51 22.91 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.584 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.579 HD11 ' HB3' ' A' ' 19' ' ' GLU . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.602 ' O ' HG23 ' A' ' 31' ' ' VAL . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 27' ' ' ARG . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.6 ' HG2' ' HE2' ' A' ' 38' ' ' PHE . 59.8 ttt85 -62.11 -40.04 94.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.49 -40.92 84.11 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.159 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 73.1 tp60 -59.96 -42.15 93.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.925 0.393 . . . . 0.0 110.064 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.489 ' HA ' ' OE1' ' A' ' 40' ' ' GLU . 39.7 t -61.54 -40.05 93.28 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.384 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.6 ' HE2' ' HG2' ' A' ' 34' ' ' ARG . 38.4 m-85 -61.84 -45.99 91.4 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -60.26 -39.12 85.64 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.559 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 47.8 mt-10 -59.98 -40.12 88.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.25 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.4 -40.03 89.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.207 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 38' ' ' PHE . 76.6 t -60.0 -41.56 86.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.17 -178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.65 94.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.18 0.514 . . . . 0.0 110.975 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.04 -39.81 87.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.197 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 -58.2 -40.03 80.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.619 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -49.2 94.81 0.01 OUTLIER Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.814 -0.708 . . . . 0.0 113.046 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 120.18 23.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 0.0 110.776 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -89.86 120.03 30.74 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 3.4 mm? 56.64 101.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.884 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 -162.36 -102.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.642 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -85.83 113.68 22.18 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-O 120.928 0.394 . . . . 0.0 111.204 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.5 m -70.04 150.02 47.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.334 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 57' ' ' VAL . 55.1 p90 -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.137 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.41 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 89.3 m-70 -59.97 -39.89 87.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.181 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.57 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER -60.0 -42.34 94.06 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.357 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 53' ' ' TYR . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.815 ' CZ ' HG23 ' A' ' 129' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.038 ' HG ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.981 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.669 HD13 HD23 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.704 ' HA ' HG12 ' A' ' 73' ' ' VAL . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.935 ' HG2' HD22 ' A' ' 97' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.715 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.414 ' N ' HG13 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.844 HD11 ' HD3' ' A' ' 93' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.715 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.619 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.619 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m -61.7 -40.08 93.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.472 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 88.0 m-85 -59.95 -43.5 94.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.983 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -151.93 154.29 35.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -113.27 103.49 55.55 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.55 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.568 ' HD2' ' HE2' ' A' ' 90' ' ' LYS . 52.0 Cg_exo -51.58 142.0 41.1 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.582 2.188 . . . . 0.0 111.864 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.9 m -72.77 -39.99 66.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -77.01 123.3 26.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.203 0.525 . . . . 0.0 111.414 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.99 -39.93 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.177 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -58.55 -30.05 66.84 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.568 ' HE2' ' HD2' ' A' ' 84' ' ' PRO . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.855 ' HA ' HD13 ' A' ' 154' ' ' LEU . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.844 ' HD3' HD11 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.752 ' CE1' HG22 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.678 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.935 HD22 ' HG2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.678 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 97' ' ' LEU . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.94 ' HE3' HD22 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.743 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.636 HD12 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.623 HD21 ' CB ' ' A' ' 61' ' ' ASP . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.654 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.574 HG21 ' HB2' ' A' ' 58' ' ' PHE . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.631 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.57 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 -59.0 144.07 46.32 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -80.04 160.07 25.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.414 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 121' ' ' MET . 13.4 t -75.57 -170.09 1.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.819 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' MET . . . . . 0.504 ' HB2' ' O ' ' A' ' 120' ' ' THR . 66.3 mtt 70.68 13.41 7.25 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.784 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -144.24 60.05 0.51 Allowed Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.635 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 77.5 m80 -64.66 -40.04 94.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 111.163 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.0 p -61.77 -39.99 93.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.863 0.363 . . . . 0.0 110.988 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.449 ' HB1' ' NH2' ' A' ' 118' ' ' ARG . . . -60.06 -23.44 63.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.668 ' CE1' ' HE3' ' A' ' 130' ' ' LYS . 59.3 t60 -66.02 -44.33 85.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.017 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.416 ' HA ' ' OE1' ' A' ' 127' ' ' GLU . 7.7 mm-40 -60.65 -42.25 96.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.472 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.69 -40.0 95.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.964 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.815 HG23 ' CZ ' ' A' ' 58' ' ' PHE . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.668 ' HE3' ' CE1' ' A' ' 126' ' ' HIS . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.466 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.038 HD13 ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.637 ' CD1' HD11 ' A' ' 69' ' ' ILE . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.91 HD21 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.597 HD13 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.752 HG22 ' CE1' ' A' ' 94' ' ' HIS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.679 ' HA2' HD12 ' A' ' 154' ' ' LEU . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -68.22 -32.53 72.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.855 HD13 ' HA ' ' A' ' 91' ' ' TYR . 83.6 mt -69.28 -25.69 64.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 58.8 tp -67.07 130.2 42.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.943 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.257 -0.877 . . . . 0.0 110.854 -179.955 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 1' ' ' MET . 57.6 ttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.761 0.315 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -81.13 -10.16 59.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -78.38 146.54 34.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.869 0.366 . . . . 0.0 111.109 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -85.9 141.05 35.37 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.589 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 132.98 33.82 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.213 1.942 . . . . 0.0 111.961 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -167.38 140.91 3.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.661 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.53 131.87 42.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.444 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.4 m -80.0 135.07 36.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.152 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.4 m -88.3 122.33 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.882 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.4 p -81.43 124.58 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.009 0.433 . . . . 0.0 111.149 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -79.03 146.37 33.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.517 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.1 m -70.23 -40.07 74.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.771 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.7 m -78.46 129.23 34.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -167.21 55.29 0.23 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.884 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.29 117.3 4.33 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.248 1.965 . . . . 0.0 111.915 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.9 mttt 59.41 45.57 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.556 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 14' ' ' GLY . 41.1 t -75.38 130.02 36.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.058 0.456 . . . . 0.0 111.221 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.6 mt -75.97 145.56 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.12 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -120.98 110.32 16.14 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -85.39 149.44 25.42 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.206 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.631 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.752 HG22 HH21 ' A' ' 27' ' ' ARG . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.752 HH21 HG22 ' A' ' 24' ' ' ILE . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.506 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 27.2 ttp85 -59.98 -40.4 88.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.95 -43.68 94.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -65.17 -39.92 93.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.654 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 33.7 t -60.66 -39.9 90.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.059 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.506 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 10.0 m-85 -60.71 -49.56 77.01 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.5 ttpt -61.31 -39.94 92.32 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 45.4 mt-10 -62.25 -39.99 94.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.344 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 37' ' ' SER . 97.6 mtt180 -66.23 -39.94 89.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 34.1 m -69.64 -40.27 79.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.28 -48.71 78.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.045 0.45 . . . . 0.0 111.535 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.96 -43.71 94.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.495 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.674 ' HD3' ' HD2' ' A' ' 48' ' ' LYS . 40.7 ttm180 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.725 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.27 -153.89 52.18 Favored Glycine 0 C--N 1.329 0.149 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -76.84 118.24 19.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.057 0.456 . . . . 0.0 110.433 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.674 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 9.6 mtpm? -81.53 152.32 27.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.674 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.591 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 83.6 mt -80.05 -13.32 59.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.266 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.8 mt-10 80.45 -44.09 0.24 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 122.677 0.391 . . . . 0.0 111.077 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -152.98 107.48 3.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.553 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -70.01 141.69 52.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.842 ' O ' HG23 ' A' ' 57' ' ' VAL . 69.3 m-85 -64.44 -20.01 65.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.307 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.428 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 91.9 m-70 -59.96 -38.9 83.84 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.519 ' HB2' ' HE2' ' A' ' 119' ' ' PHE . 2.8 tm? -60.07 -44.95 94.39 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 53' ' ' TYR . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 115' ' ' ARG . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.009 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.757 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.77 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.51 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.785 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 93' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 146' ' ' LEU . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 73' ' ' VAL . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t -62.19 -39.79 93.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.715 ' HD2' ' HG3' ' A' ' 82' ' ' GLU . 64.8 t80 -58.52 -43.43 89.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.014 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.715 ' HG3' ' HD2' ' A' ' 81' ' ' TYR . 64.1 mt-10 -115.07 143.27 45.45 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.741 0.305 . . . . 0.0 110.944 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.479 ' N ' ' HD3' ' A' ' 84' ' ' PRO . 2.4 t70 -121.43 51.26 2.55 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.447 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.577 ' HD3' ' HB3' ' A' ' 82' ' ' GLU . 79.7 Cg_endo -84.53 149.5 11.49 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.688 2.258 . . . . 0.0 111.842 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.1 m -83.3 -73.12 0.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.866 0.365 . . . . 0.0 110.682 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.7 121.89 24.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.599 HG23 ' O ' ' A' ' 87' ' ' ILE . 7.4 tt -162.74 89.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.448 0.642 . . . . 0.0 111.649 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 -60.56 -39.93 89.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.525 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 150' ' ' LYS . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.639 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.692 ' HE2' HD12 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.798 ' HA ' HD12 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.671 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.671 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.714 HG22 ' HH2' ' A' ' 68' ' ' TRP . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' GLU . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 1.009 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.759 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.838 ' HG3' HD11 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.762 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.762 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.761 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -103.1 140.04 37.83 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.519 ' HE2' ' HB2' ' A' ' 55' ' ' LEU . 95.7 m-85 60.4 65.67 1.04 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.09 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.445 ' O ' ' HB2' ' A' ' 121' ' ' MET . 18.2 p -74.77 154.65 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.007 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' A' ' 120' ' ' THR . 97.3 mtp 67.73 10.4 7.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.509 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -101.39 93.77 1.17 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.979 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -67.65 -40.1 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 0.0 111.235 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.9 m -63.49 -40.09 96.17 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.833 0.349 . . . . 0.0 111.192 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.59 -22.46 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.32 -42.85 82.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.256 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.49 -42.61 96.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.4 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.35 -42.57 79.05 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.761 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.442 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.838 HD11 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.902 HD13 HD23 ' A' ' 65' ' ' LEU . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.56 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.755 ' HA ' HD12 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.807 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.439 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.3 -31.75 70.45 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.515 HD13 ' HD2' ' A' ' 91' ' ' TYR . 10.3 tt -69.11 -26.39 64.89 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.811 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 88.9 mt -68.36 137.4 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.05 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.764 179.88 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 120.923 0.392 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -71.95 -30.06 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -76.0 129.53 37.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.035 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -86.28 114.5 57.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.05 135.06 12.08 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.561 2.174 . . . . 0.0 112.375 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -75.63 134.6 40.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.719 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -100.03 124.36 45.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 71.7 p -79.93 135.59 36.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.4 m -84.95 132.66 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.216 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.8 t -80.7 129.99 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -77.23 145.32 37.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.733 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.1 m -79.71 -10.38 59.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.311 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.627 ' O ' ' HD3' ' A' ' 15' ' ' PRO . 38.1 p 49.61 41.78 22.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.569 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -87.19 102.96 2.83 Favored Glycine 0 CA--C 1.521 0.406 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.484 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.627 ' HD3' ' O ' ' A' ' 13' ' ' SER . 83.1 Cg_endo -80.4 146.16 17.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.746 2.297 . . . . 0.0 112.487 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.6 mttm 64.25 118.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.99 133.11 32.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.187 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 tp -75.48 131.37 40.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.424 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HB3' ' CG1' ' A' ' 24' ' ' ILE . 76.1 mm-40 -122.35 109.25 14.19 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.493 ' O ' HG13 ' A' ' 24' ' ' ILE . 17.2 m -81.03 161.33 24.26 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.854 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.417 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.649 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.683 ' O ' HG23 ' A' ' 31' ' ' VAL . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.649 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 27' ' ' ARG . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -62.96 -42.03 99.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.428 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 39.4 m-85 -59.9 -44.45 94.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.8 0.333 . . . . 0.0 111.101 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.69 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.2 mt-30 -69.96 -40.53 75.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 67.6 m -60.99 -39.98 91.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.038 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.74 -49.56 77.0 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -61.16 -39.96 92.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 114.533 -1.212 . . . . 0.0 108.265 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.69 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.3 mt-10 -60.91 -41.42 96.08 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.29 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 37' ' ' SER . 60.5 mtp180 -60.02 -40.08 88.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.846 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.824 HG13 ' NH2' ' A' ' 45' ' ' ARG . 78.1 t -65.45 -47.87 85.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.07 94.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.68 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.6 mt-10 -59.97 -40.08 87.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.939 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.824 ' NH2' HG13 ' A' ' 42' ' ' VAL . 28.5 mtm105 -59.91 -40.11 87.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.591 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 56.99 -161.68 7.76 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.567 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -78.23 116.39 18.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.871 0.367 . . . . 0.0 110.613 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -84.65 149.47 25.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.11 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 61.8 tp -69.93 -40.03 75.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.444 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.634 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 48.7 mt-10 87.57 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.011 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -83.61 164.61 19.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.876 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 m -69.62 123.92 22.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.67 ' O ' HG13 ' A' ' 57' ' ' VAL . 2.2 t80 -60.09 -19.78 54.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.516 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.564 ' HA ' HG22 ' A' ' 57' ' ' VAL . 74.4 m80 -60.75 -41.29 95.12 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp -69.95 -47.56 61.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 53' ' ' TYR . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.553 ' HZ ' HG23 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.734 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.728 HD12 HD13 ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.864 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 140' ' ' TRP . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.621 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.683 ' HE2' HD23 ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' N ' HG13 ' A' ' 73' ' ' VAL . 21.0 m-80 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.652 HD11 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 146' ' ' LEU . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t -62.01 -47.1 86.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.537 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 64.4 t80 -60.02 -48.69 80.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.022 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.537 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 40.1 mt-10 -138.61 155.53 48.24 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.767 0.318 . . . . 0.0 110.817 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -130.3 75.49 79.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.654 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD2' ' NZ ' ' A' ' 90' ' ' LYS . 50.8 Cg_exo -52.16 147.19 28.25 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.273 1.982 . . . . 0.0 111.951 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.6 t -84.01 -3.57 58.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.349 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -77.09 108.49 10.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.979 0.418 . . . . 0.0 111.277 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.3 -39.9 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.674 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.444 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 64.0 tt0 -59.62 -40.05 86.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.474 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.666 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.592 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 30.9 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.799 ' O ' HD13 ' A' ' 97' ' ' LEU . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.666 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.799 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.685 ' O ' HG22 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.864 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLN . . . . . 0.5 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.708 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.742 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.686 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.686 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 -103.64 140.01 38.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.589 ' O ' ' HD1' ' A' ' 119' ' ' PHE . 0.1 OUTLIER -90.58 109.95 21.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.21 179.185 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.39 118.98 24.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.744 0.307 . . . . 0.0 110.612 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 57.6 ttm -76.01 -40.08 54.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.759 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.26 7.06 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.796 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 81.9 t60 -66.65 -40.0 88.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.822 0.344 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 77.1 p -63.26 -39.78 95.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.568 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -23.25 50.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 40.6 m170 -66.76 -42.58 85.92 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.58 -43.84 98.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.571 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.58 -44.95 95.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.004 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.553 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.734 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.709 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.728 HD13 HD12 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.709 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.71 ' CD1' HD11 ' A' ' 69' ' ' ILE . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.609 ' O ' HD13 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.645 HD21 ' HD2' ' A' ' 72' ' ' LYS . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.561 HD22 ' HZ3' ' A' ' 140' ' ' TRP . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 76' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.667 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.474 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.776 ' HA2' HD12 ' A' ' 154' ' ' LEU . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -69.98 -29.29 66.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.776 HD12 ' HA2' ' A' ' 151' ' ' GLY . 83.9 mt -69.43 -25.88 64.34 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.809 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 95.1 mt -67.7 130.18 42.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 110.9 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.142 180.0 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.8 mtm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.862 0.363 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -39.88 75.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.875 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -74.05 147.39 42.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 4.4 m-85 -85.83 129.44 54.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.097 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 4' ' ' PHE . 21.6 Cg_exo -65.18 149.92 88.23 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.562 2.175 . . . . 0.0 112.505 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -76.56 154.43 34.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.518 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 134.6 57.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.972 0.415 . . . . 0.0 110.797 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 t -81.59 133.68 35.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.572 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.98 135.72 24.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.518 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 m -73.65 129.31 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 121.116 0.484 . . . . 0.0 111.23 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -79.74 152.43 29.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.457 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -76.45 160.32 29.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.759 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.1 m -70.54 129.99 40.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.155 0.502 . . . . 0.0 111.132 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.85 -146.69 7.11 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.684 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.54 118.47 5.5 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.174 1.916 . . . . 0.0 111.566 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -81.55 26.68 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.7 t -77.84 113.4 16.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.852 0.358 . . . . 0.0 110.586 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.9 tp -78.56 118.48 20.72 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.803 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.765 ' HG3' HD11 ' A' ' 24' ' ' ILE . 86.1 tt0 -123.0 108.97 13.52 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.73 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m -92.16 149.77 21.29 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.479 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.73 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 19' ' ' GLU . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.467 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.65 ' O ' HG23 ' A' ' 31' ' ' VAL . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 27' ' ' ARG . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -65.93 -40.02 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.554 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 61.4 t80 -59.93 -41.07 91.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.77 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 66.9 tt0 -59.96 -39.99 87.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.103 0.477 . . . . 0.0 110.334 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 71.3 m -60.36 -38.12 82.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -60.2 -46.11 90.84 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 95.3 mttt -61.11 -38.29 85.81 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.97 -1.014 . . . . 0.0 108.848 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' HB3' ' O ' ' A' ' 37' ' ' SER . 86.5 tt0 -60.05 -40.42 89.34 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.616 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -60.31 -40.32 90.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 64.2 t -61.32 -42.3 93.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.677 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.04 87.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.769 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.635 ' O ' ' HG3' ' A' ' 47' ' ' GLN . 86.3 tt0 -59.47 -38.98 82.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' C ' ' H ' ' A' ' 47' ' ' GLN . 58.3 mtp180 -59.94 -38.8 83.47 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.88 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.42 28.1 0.17 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 114.539 0.576 . . . . 0.0 114.539 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 94.0 mt-30 -76.18 122.84 24.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 118.01 0.905 . . . . 0.0 110.276 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.623 ' HE3' ' HA ' ' A' ' 51' ' ' ASP . 55.3 pttt -86.63 114.36 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.177 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.4 mm? -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.441 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.9 mt-10 -62.16 -39.99 94.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.064 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.623 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 95.6 m-20 65.77 109.18 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.339 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.8 m -69.29 149.95 47.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.144 0.497 . . . . 0.0 110.794 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.663 ' O ' HG23 ' A' ' 57' ' ' VAL . 91.2 m-85 -63.63 -23.21 67.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.889 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.405 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 32.5 m170 -59.97 -40.0 87.58 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.848 0.356 . . . . 0.0 111.004 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD2' ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt -60.82 -42.87 98.57 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 53' ' ' TYR . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.62 ' HZ ' HG23 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HE3' ' CD2' ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 1.013 ' HA ' HD12 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.013 HD12 ' HA ' ' A' ' 62' ' ' ALA . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.628 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.937 HG23 HD11 ' A' ' 143' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.593 ' HA ' HG12 ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE2' HD13 ' A' ' 97' ' ' LEU . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.593 HG12 ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.585 HD21 HD12 ' A' ' 146' ' ' LEU . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HE2' HD12 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.638 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m -62.1 -40.02 94.47 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -58.62 -49.96 75.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -89.93 -79.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.78 0.324 . . . . 0.0 111.465 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.1 p30 -171.62 158.65 4.71 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -85.69 65.31 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.603 2.202 . . . . 0.0 112.033 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.473 ' O ' ' HD2' ' A' ' 90' ' ' LYS . 40.2 m -81.72 135.11 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.823 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.629 ' OD1' HD13 ' A' ' 154' ' ' LEU . 59.6 t-20 -76.69 127.65 33.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.786 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.65 HG13 ' H ' ' A' ' 90' ' ' LYS . 46.9 pt -154.52 157.58 4.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -59.96 -37.84 80.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.734 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.65 ' H ' HG13 ' A' ' 87' ' ' ILE . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.609 ' NE2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 80.7 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.708 ' O ' HG23 ' A' ' 101' ' ' VAL . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.63 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.507 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.644 ' HA ' ' OG1' ' A' ' 103' ' ' THR . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 97' ' ' LEU . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.644 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.576 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.658 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.445 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.666 ' HG3' ' HG3' ' A' ' 121' ' ' MET . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.467 ' HB3' ' CE1' ' A' ' 119' ' ' PHE . 79.2 mtp85 -100.97 101.89 12.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 118' ' ' ARG . 1.7 p90 39.46 -90.14 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.743 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 118' ' ' ARG . 14.7 t -161.29 20.88 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.897 0.379 . . . . 0.0 110.732 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 115' ' ' ARG . 99.6 mmm 49.33 178.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.753 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -87.3 156.86 28.62 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.602 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.467 ' HA ' ' ND1' ' A' ' 126' ' ' HIS . 29.2 p-80 -65.93 -40.2 91.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.2 p -75.21 -39.99 59.56 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 0.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -22.57 62.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.74 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.487 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 48.7 m170 -65.23 -43.92 89.92 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -60.72 -45.11 95.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.07 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -62.67 -45.71 91.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.468 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.62 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 126' ' ' HIS . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.689 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.471 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.01 HD21 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.651 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.794 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.937 HD11 HG23 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 142' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.609 HG22 ' NE2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.446 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -68.08 -28.53 67.44 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.629 HD13 ' OD1' ' A' ' 86' ' ' ASN . 0.7 OUTLIER -68.55 -22.25 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.135 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 87.4 mt -65.22 137.65 57.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 83.0 mtt85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.935 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 ttm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.901 0.382 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -40.05 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.0 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -75.83 130.56 38.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.167 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -85.6 149.4 51.42 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.004 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.38 139.46 59.62 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.57 2.18 . . . . 0.0 112.075 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -78.99 -6.91 57.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -93.57 120.01 33.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.748 0.308 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.0 m -80.01 132.32 35.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 9' ' ' VAL . 11.6 p -89.09 119.97 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.602 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.754 HG11 ' HD2' ' A' ' 16' ' ' LYS . 21.5 t -84.7 119.16 33.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.465 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -81.56 131.16 35.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.1 m -77.82 126.99 31.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.394 . . . . 0.0 110.897 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -162.58 -26.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.34 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.62 -151.3 11.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.332 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.79 133.62 58.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.585 2.19 . . . . 0.0 112.133 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.754 ' HD2' HG11 ' A' ' 10' ' ' VAL . 61.4 pttt -159.98 60.27 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.182 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -77.65 130.48 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.64 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.7 mt -77.76 130.37 36.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.296 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' OE2' HD12 ' A' ' 24' ' ' ILE . 82.9 tt0 -122.66 109.24 14.02 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.618 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.4 m -84.66 156.57 21.46 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.579 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.487 ' HA ' HG22 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.489 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.618 HG22 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.489 ' N ' HG23 ' A' ' 24' ' ' ILE . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 31' ' ' VAL . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.804 ' O ' HD23 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 27' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 95.6 mtt-85 -66.02 -40.02 90.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' HE3' ' A' ' 39' ' ' LYS . 64.8 t80 -58.3 -41.54 84.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.554 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.675 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.8 mt-30 -67.0 -40.06 87.27 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.539 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.504 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 66.1 p -61.3 -37.93 85.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.138 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.603 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 27.3 m-85 -60.97 -48.88 79.76 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HE3' ' CZ ' ' A' ' 35' ' ' TYR . 97.7 mttt -62.37 -35.0 77.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.176 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.8 mt-10 -59.97 -42.46 94.18 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.633 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HD2' ' O ' ' A' ' 37' ' ' SER . 1.7 mpt_? -66.45 -40.18 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 110.911 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' PHE . 99.4 t -63.15 -43.29 98.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.667 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.98 -44.25 94.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.068 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.01 -44.37 94.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.056 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 45' ' ' ARG . 73.2 mtt-85 -60.05 -39.96 87.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.2 105.46 1.3 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.522 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -80.19 121.08 25.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.826 0.346 . . . . 0.0 110.495 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 95.9 mttt -84.81 117.26 23.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.316 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.85 -42.49 70.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 13.3 pt-20 -178.77 106.21 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 111.148 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 48' ' ' LYS . 97.8 m-20 -80.2 127.0 31.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.044 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.0 t -70.11 129.95 40.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.276 0.56 . . . . 0.0 111.549 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.741 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.8 p90 -65.6 -17.9 64.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.446 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.442 ' HA ' ' CG2' ' A' ' 57' ' ' VAL . 68.8 m-70 -56.2 -36.52 68.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.368 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 3.1 tm? -59.78 -45.06 93.46 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 53' ' ' TYR . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.0 HD22 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.768 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.52 HG23 ' CD2' ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.654 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.906 ' HD3' HD23 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.691 ' HA ' HD12 ' A' ' 76' ' ' LEU . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.681 HG21 ' CD2' ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 72' ' ' LYS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.558 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.535 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.533 ' HZ3' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t -63.91 -44.76 91.96 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.535 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 70.4 m-85 -59.93 -39.97 87.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.058 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.525 ' HG3' ' HD2' ' A' ' 84' ' ' PRO . 52.1 tp10 -64.05 124.05 20.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.61 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 20.0 m-20 -59.99 -53.83 61.41 Favored Pre-proline 0 N--CA 1.462 0.153 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.393 -178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 77.2 Cg_exo -47.94 156.21 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.479 2.119 . . . . 0.0 112.76 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.6 p -82.66 -178.21 7.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.772 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.664 ' HA ' ' HD2' ' A' ' 90' ' ' LYS . 64.4 t30 -74.38 142.2 45.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.64 ' N ' HD13 ' A' ' 87' ' ' ILE . 0.2 OUTLIER -154.52 -162.53 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.025 -179.115 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.595 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 -60.07 -39.96 87.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.676 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.742 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.635 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 52.0 m80 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.638 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.906 HD23 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.638 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 97' ' ' LEU . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 1.0 ' HE3' HD22 ' A' ' 65' ' ' LEU . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.779 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.622 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.779 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 114' ' ' THR . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.829 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.829 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.705 ' HD2' HG21 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -106.48 -105.48 0.33 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -88.53 133.15 34.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.725 0.297 . . . . 0.0 110.802 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 t -157.21 27.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.011 0.434 . . . . 0.0 110.948 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 90.8 mmm -81.31 -36.07 30.22 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.767 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.3 110.24 3.02 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.442 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.538 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 50.6 p-80 -67.13 -40.06 86.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.35 . . . . 0.0 110.872 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.5 p -60.89 -40.06 91.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.66 ' O ' ' HG2' ' A' ' 128' ' ' GLU . . . -58.38 -24.06 58.87 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.566 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 76.0 m80 -68.06 -42.37 80.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.068 0.461 . . . . 0.0 110.166 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -43.63 95.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.218 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' ' 125' ' ' ALA . 14.5 pt-20 -61.51 -43.61 98.55 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.84 -0.344 . . . . 0.0 111.031 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.705 HG21 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 111' ' ' LEU . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.78 HD13 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.675 ' NE1' HG13 ' A' ' 101' ' ' VAL . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.677 ' HA ' HD12 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.679 ' O ' HD23 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.677 HD12 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.679 HD23 ' O ' ' A' ' 144' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.533 ' HD2' ' HZ3' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 -70.02 -20.63 63.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.476 ' HB3' ' O ' ' A' ' 151' ' ' GLY . 61.4 tp -68.98 -25.76 64.69 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.008 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.05 133.85 47.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.124 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.845 179.546 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.628 0.251 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 62.82 79.54 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.94 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -71.29 141.47 50.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.789 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.515 ' CZ ' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -85.9 132.67 43.26 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.379 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.558 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 61.4 Cg_endo -73.17 145.82 39.79 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.421 2.08 . . . . 0.0 112.203 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 61.3 mttm 79.22 179.95 0.11 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.939 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -86.08 126.79 34.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.673 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.515 HG21 ' CZ ' ' A' ' 4' ' ' PHE . 73.0 p -80.02 129.73 34.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.169 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 t -94.39 120.0 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 39.6 t -83.57 120.07 34.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.666 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 98.9 mt-10 -157.48 116.24 3.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.919 0.39 . . . . 0.0 111.251 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 t -158.04 100.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.736 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.33 26.39 13.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.893 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.85 109.74 3.37 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.675 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.5 164.66 12.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.555 2.17 . . . . 0.0 112.027 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -74.67 151.67 39.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.388 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.9 129.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.871 0.367 . . . . 0.0 110.576 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 118.41 19.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.086 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.641 ' HG2' ' CG1' ' A' ' 24' ' ' ILE . 56.6 tt0 -122.46 109.69 14.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.58 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.1 m -88.21 151.87 22.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.74 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.492 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.641 ' CG1' ' HG2' ' A' ' 19' ' ' GLU . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 7.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.412 ' O ' HG23 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 25' ' ' GLN . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' O ' ' HD2' ' A' ' 35' ' ' TYR . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -60.12 -46.67 88.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.453 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 72.0 m-85 -60.09 -45.45 92.87 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.243 0.544 . . . . 0.0 110.417 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 56.8 tt0 -65.99 -38.04 87.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 21.5 t -60.4 -40.02 89.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.271 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.92 -48.6 81.06 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 36' ' ' GLN . 7.9 mtmm -62.18 -38.96 91.09 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' ' HA ' ' A' ' 37' ' ' SER . 86.4 tt0 -60.01 -39.92 87.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.583 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 37' ' ' SER . 99.7 mtt180 -59.23 -40.05 84.65 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.784 -179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -60.01 -46.67 93.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.93 94.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.3 mt-10 -56.41 -25.85 51.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.329 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.456 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 106.92 10.76 27.7 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.219 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -77.74 114.46 16.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.456 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -91.05 114.32 26.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.2 tp -90.02 -80.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.076 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -71.68 -54.3 10.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.511 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -156.45 -164.24 1.62 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.88 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.7 m -69.49 130.29 42.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.087 0.47 . . . . 0.0 110.324 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.66 ' O ' HG23 ' A' ' 57' ' ' VAL . 64.7 t80 -59.74 -19.65 51.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.036 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.495 ' ND1' ' HD2' ' A' ' 118' ' ' ARG . 37.2 t-80 -59.41 -40.01 85.25 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.576 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp -60.11 -44.52 94.81 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 53' ' ' TYR . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.688 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.898 HD22 HD23 ' A' ' 136' ' ' LEU . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.676 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.733 HG23 HD22 ' A' ' 143' ' ' LEU . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.701 ' HA ' HG12 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.635 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.648 ' HD2' HD21 ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.701 HG12 ' HA ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.635 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.766 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.781 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.601 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.781 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t -60.49 -40.21 90.5 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.601 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 93.6 m-85 -59.75 -33.38 71.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.084 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 60.33 43.32 13.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.046 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -70.03 160.01 82.1 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.45 52.17 0.63 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.879 2.386 . . . . 0.0 112.439 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.4 t -85.95 155.73 20.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.867 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -76.73 142.59 40.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.614 HD11 ' HD2' ' A' ' 156' ' ' ARG . 85.5 mt -69.68 -39.91 78.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.997 -178.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.03 -40.04 87.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.81 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.456 ' HB2' HD21 ' A' ' 154' ' ' LEU . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.81 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 29.5 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HG23 ' A' ' 101' ' ' VAL . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.642 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.676 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.798 HG13 ' HE1' ' A' ' 140' ' ' TRP . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.833 ' HD3' HD12 ' A' ' 107' ' ' LEU . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.627 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 133' ' ' ILE . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.685 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.597 ' HG2' HG21 ' A' ' 129' ' ' THR . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.495 ' HD2' ' ND1' ' A' ' 54' ' ' HIS . 8.4 mtt-85 -105.64 140.08 39.25 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 60.09 96.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.88 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.2 t -79.32 168.23 19.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.659 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 68.0 mtt 63.67 100.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.917 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 165.97 70.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.444 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.443 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 45.3 p-80 -63.65 -40.06 95.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 0.0 110.778 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.4 m -61.15 -39.99 92.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.293 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.09 -24.68 59.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.013 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.443 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.28 -40.14 86.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.121 0.486 . . . . 0.0 109.86 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.0 -40.03 87.82 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.488 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -64.66 -43.36 93.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.597 HG21 ' HG2' ' A' ' 115' ' ' ARG . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.556 ' O ' HD13 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 111' ' ' LEU . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.898 HD23 HD22 ' A' ' 65' ' ' LEU . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.798 ' HE1' HG13 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.453 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.733 HD22 HG23 ' A' ' 69' ' ' ILE . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.717 HD21 HG11 ' A' ' 101' ' ' VAL . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 143' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.914 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.914 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -69.71 -24.07 63.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 90' ' ' LYS . 69.0 tp -68.27 -25.97 65.43 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.846 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.09 130.15 39.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.707 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.614 ' HD2' HD11 ' A' ' 87' ' ' ILE . 78.7 mtp180 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.916 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mmm . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.828 0.347 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -79.95 -10.28 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.154 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.22 142.15 39.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.827 0.346 . . . . 0.0 110.868 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -85.98 116.98 67.85 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.434 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.38 133.31 34.38 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.441 2.094 . . . . 0.0 112.142 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -70.2 -40.0 74.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.777 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -103.24 125.59 49.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.966 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 t -80.11 128.85 33.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.604 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 m -88.86 117.35 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 CA-C-O 120.928 0.394 . . . . 0.0 111.068 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.8 t -84.2 126.0 40.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.167 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -78.59 129.19 34.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.594 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -160.95 120.73 2.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.276 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.1 p -157.81 9.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -90.06 -89.82 1.28 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.486 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.86 155.12 11.43 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.479 2.12 . . . . 0.0 112.311 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -75.85 143.56 41.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.01 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.7 m -75.37 133.74 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.977 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -75.68 121.58 22.71 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.678 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' A' ' 24' ' ' ILE . 99.2 mt-10 -121.77 110.85 16.42 Favored 'General case' 0 N--CA 1.419 -2.011 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.658 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER -80.79 158.1 25.55 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.643 -179.009 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.658 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.794 HD11 ' HB3' ' A' ' 19' ' ' GLU . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.59 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.739 ' O ' HG22 ' A' ' 31' ' ' VAL . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.6 ' HA ' ' CG2' ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 27' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.64 ' O ' ' HD2' ' A' ' 38' ' ' PHE . 95.4 mtt-85 -65.72 -40.3 92.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -59.67 -45.25 92.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.732 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -61.22 -42.26 98.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.058 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -39.99 92.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.865 0.364 . . . . 0.0 111.777 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.64 ' HD2' ' O ' ' A' ' 34' ' ' ARG . 48.4 m-85 -67.92 -45.61 73.88 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.01 -39.97 87.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.704 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.732 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.4 mt-10 -59.78 -43.97 94.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.1 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 mtp-105 -66.05 -40.02 90.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.844 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 38' ' ' PHE . 48.3 t -67.32 -42.25 87.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.71 -47.99 83.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.95 -45.06 93.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.478 ' O ' ' HG2' ' A' ' 121' ' ' MET . 59.9 ttt85 -60.3 -39.78 88.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.378 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 72.01 141.75 0.35 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.1 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -79.15 112.76 16.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.769 0.319 . . . . 0.0 110.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 58.5 tttp -89.4 136.95 32.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.214 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 84.7 mt -161.5 -64.67 0.06 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.701 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.8 mt-10 -65.63 -39.89 91.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.213 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.413 ' OD1' ' HE3' ' A' ' 48' ' ' LYS . 66.1 m-20 69.42 102.29 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.078 0.466 . . . . 0.0 110.202 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.9 p -69.81 148.35 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.58 -178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.799 ' O ' HG23 ' A' ' 57' ' ' VAL . 86.0 m-85 -69.91 -19.06 63.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.563 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.778 ' HB3' HH11 ' A' ' 118' ' ' ARG . 72.3 m80 -55.46 -38.63 69.3 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.631 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -60.44 -43.09 97.16 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.025 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.498 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 53' ' ' TYR . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.562 ' HB2' ' NE ' ' A' ' 118' ' ' ARG . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.415 ' N ' ' O ' ' A' ' 56' ' ' GLN . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.889 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.452 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.644 HD12 HD13 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.862 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.94 HG23 HD11 ' A' ' 143' ' ' LEU . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.459 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.902 ' HD2' HD11 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 1.123 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.853 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.757 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.601 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.853 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m -60.71 -40.05 90.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.601 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 91.0 m-85 -58.74 -41.63 86.91 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.433 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.963 ' HG3' ' HD3' ' A' ' 84' ' ' PRO . 51.2 tp10 -140.08 128.59 22.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.957 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.57 68.17 81.18 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.851 0.358 . . . . 0.0 111.501 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.963 ' HD3' ' HG3' ' A' ' 82' ' ' GLU . 86.7 Cg_endo -85.17 179.4 4.13 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.943 2.429 . . . . 0.0 111.72 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.3 m -79.91 -70.41 0.52 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.471 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.63 ' C ' HG13 ' A' ' 87' ' ' ILE . 98.1 m-20 -78.12 128.47 33.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.578 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.847 HD13 ' HD2' ' A' ' 90' ' ' LYS . 18.8 mt -154.81 87.3 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.881 0.372 . . . . 0.0 111.32 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.465 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 -61.15 -40.03 92.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.907 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.847 ' HD2' HD13 ' A' ' 87' ' ' ILE . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 1.123 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.741 ' CE1' HG22 ' A' ' 147' ' ' THR . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.705 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 28.3 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.902 HD11 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.889 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.862 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.889 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.47 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.709 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.683 HD23 HD12 ' A' ' 133' ' ' ILE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.461 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.526 ' O ' ' HB ' ' A' ' 120' ' ' THR . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.778 HH11 ' HB3' ' A' ' 54' ' ' HIS . 85.1 mtt-85 -81.28 -169.28 2.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.575 ' O ' HG22 ' A' ' 120' ' ' THR . 87.2 m-85 -70.1 -38.8 75.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.559 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 119' ' ' PHE . 7.6 t 48.59 34.67 5.17 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.832 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 73.8 mtm -84.21 133.14 34.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.714 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 118.52 106.55 2.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.872 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.542 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 52.7 p-80 -64.63 -40.04 94.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.565 0.221 . . . . 0.0 111.289 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.4 p -69.6 -39.97 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.903 0.383 . . . . 0.0 110.268 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.81 ' O ' HG22 ' A' ' 129' ' ' THR . . . -59.87 -23.08 63.14 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.542 ' HB3' ' O ' ' A' ' 123' ' ' HIS . 56.3 t-80 -66.15 -45.1 82.18 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.043 179.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.36 -43.38 97.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.307 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -62.35 -46.71 87.44 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.518 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.81 HG22 ' O ' ' A' ' 125' ' ' ALA . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 135' ' ' GLU . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.889 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.683 HD12 HD23 ' A' ' 111' ' ' LEU . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.644 HD13 HD12 ' A' ' 65' ' ' LEU . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.47 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.73 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.94 HD11 HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.685 HD21 HG11 ' A' ' 101' ' ' VAL . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.744 HD13 ' CD2' ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.751 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.751 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.481 ' HA2' ' HB2' ' A' ' 154' ' ' LEU . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -70.05 -25.35 63.51 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 150' ' ' LYS . 3.4 mm? -68.68 -24.94 64.57 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.947 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.25 137.41 56.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.947 -179.97 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.916 0.389 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 59.29 -175.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.993 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -75.58 149.94 38.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.997 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -85.07 151.15 56.74 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.825 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.36 137.35 73.93 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.485 2.123 . . . . 0.0 112.159 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -161.56 160.06 28.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.13 142.55 57.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.737 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -76.96 134.86 38.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.275 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.6 m -84.92 135.36 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.562 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 16.1 m -77.25 139.65 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.289 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 10' ' ' VAL . 47.4 mt-10 71.32 141.32 0.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.005 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 4.1 m 68.34 20.36 8.69 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.305 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.3 t -79.97 -8.45 59.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.248 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.577 ' N ' ' HD2' ' A' ' 15' ' ' PRO . . . 159.93 -51.12 0.37 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.573 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 14' ' ' GLY . 21.4 Cg_endo -60.8 156.13 45.03 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.363 2.042 . . . . 0.0 112.189 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -78.02 123.44 26.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.804 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.7 t -82.15 113.89 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.428 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -80.02 125.65 30.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.686 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -122.41 109.44 14.4 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.777 0.798 . . . . 0.0 108.932 177.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.7 ' O ' HG22 ' A' ' 24' ' ' ILE . 2.9 m -91.95 152.47 20.01 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.801 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 25' ' ' GLN . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.529 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.657 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.7 HG22 ' O ' ' A' ' 20' ' ' THR . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.648 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.477 ' CG ' ' HE2' ' A' ' 38' ' ' PHE . 60.2 ttp180 -62.39 -41.37 98.6 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -59.99 -41.53 92.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.9 -40.0 93.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.86 0.362 . . . . 0.0 110.709 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.2 m -62.43 -39.98 95.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.312 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.477 ' HE2' ' CG ' ' A' ' 34' ' ' ARG . 40.0 m-85 -65.79 -48.55 71.38 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -60.42 -39.97 89.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.606 177.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -44.54 94.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.871 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.601 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 32.6 ttt85 -63.19 -40.05 96.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.872 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 38' ' ' PHE . 66.1 t -69.23 -43.93 81.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -46.91 87.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.617 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.627 ' HA ' ' CE ' ' A' ' 48' ' ' LYS . 14.1 pt-20 -60.08 -40.36 89.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.558 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 29.4 mmt85 -60.06 -39.98 87.9 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.029 0.442 . . . . 0.0 110.814 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -98.09 -170.11 32.2 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.949 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 5.4 pm0 -76.31 119.04 19.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.142 0.496 . . . . 0.0 110.406 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.627 ' CE ' ' HA ' ' A' ' 44' ' ' GLU . 55.7 mttt -81.78 144.27 31.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.909 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.1 mp -70.11 -35.13 73.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.407 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.34 -37.16 84.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.882 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' CG ' HD13 ' A' ' 55' ' ' LEU . 95.9 m-20 -79.56 143.1 35.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.855 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.2 t -69.57 163.98 24.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.035 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 57' ' ' VAL . 96.0 m-85 -60.03 -32.37 70.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.456 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.48 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 77.2 m80 -59.44 -39.59 84.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.7 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.509 HD13 ' CG ' ' A' ' 51' ' ' ASP . 7.8 tt -60.0 -44.15 94.72 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.521 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 53' ' ' TYR . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.628 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.659 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.655 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.848 HD23 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.783 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.747 ' HA ' HG12 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.631 ' HD2' ' O ' ' A' ' 68' ' ' TRP . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.747 HG12 ' HA ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.668 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.445 ' CD2' HD13 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.641 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.668 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t -62.95 -40.11 96.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.706 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 68.1 t80 -58.84 -49.82 76.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.091 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.706 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 96.5 mt-10 -126.03 -87.4 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.844 0.354 . . . . 0.0 110.779 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -151.41 150.66 27.38 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.257 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.61 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 27.2 Cg_exo -61.13 -175.56 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.035 1.823 . . . . 0.0 111.682 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.729 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 1.4 p -81.75 138.26 35.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.269 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -78.43 129.19 34.64 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.726 HG13 ' H ' ' A' ' 88' ' ' GLN . 8.8 pt 36.5 -86.73 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.726 ' H ' HG13 ' A' ' 87' ' ' ILE . 77.8 mt-30 -59.96 -39.98 87.46 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -177.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.879 ' HD2' HD22 ' A' ' 154' ' ' LEU . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.426 ' CZ ' HD21 ' A' ' 154' ' ' LEU . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.707 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.592 ' CD2' HG22 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 101' ' ' VAL . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.657 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.783 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.766 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.739 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.62 HD12 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.739 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.575 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.503 ' HG3' ' CD2' ' A' ' 119' ' ' PHE . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 -106.18 -30.92 8.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PHE . . . . . 0.503 ' CD2' ' HG3' ' A' ' 115' ' ' ARG . 78.0 m-85 -92.08 139.97 30.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.971 0.415 . . . . 0.0 111.094 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 15.2 t -157.0 28.26 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.728 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 27.0 ttt -152.11 -36.28 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.04 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -78.78 93.35 1.27 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.577 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 75.5 m80 -68.27 -39.96 82.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.9 p -60.76 -39.89 90.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.046 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.29 -25.31 47.97 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.45 -41.97 83.86 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.89 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.59 -41.97 95.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.017 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -62.68 -41.08 98.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.67 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.658 ' NE2' HD11 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.488 HG23 ' HE2' ' A' ' 108' ' ' MET . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.848 HD13 HD23 ' A' ' 65' ' ' LEU . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.504 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 146' ' ' LEU . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.552 HD21 HG11 ' A' ' 101' ' ' VAL . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.77 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.517 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.96 -21.16 63.28 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.879 HD22 ' HD2' ' A' ' 90' ' ' LYS . 56.6 tp -68.31 -26.04 65.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.164 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.4 137.39 52.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.594 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.86 -179.762 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.612 0.244 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -79.99 -9.96 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.229 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -74.53 137.57 42.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.839 0.352 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -85.47 140.24 36.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.09 135.49 47.61 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.161 . . . . 0.0 112.141 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -80.01 -9.92 59.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -94.83 135.17 36.65 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.872 0.368 . . . . 0.0 110.606 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 70.6 p -79.53 132.97 36.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 9' ' ' VAL . 11.9 p -91.35 119.92 39.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.143 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.6 t -80.83 127.19 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.92 0.391 . . . . 0.0 110.729 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.773 ' HB3' ' HD3' ' A' ' 15' ' ' PRO . 84.3 tt0 -79.12 132.1 36.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -78.72 130.0 35.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.068 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.94 35.41 21.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.625 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -131.88 -82.26 0.23 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.224 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.773 ' HD3' ' HB3' ' A' ' 11' ' ' GLU . 98.4 Cg_endo -80.16 138.76 12.93 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.434 2.756 . . . . 0.0 112.98 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm 60.14 39.94 18.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.258 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 14' ' ' GLY . 39.5 t -80.16 116.91 25.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' C ' ' A' ' 18' ' ' LEU . 10.2 tt -80.07 106.09 11.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 1.07 ' HB2' HD11 ' A' ' 24' ' ' ILE . 14.4 pt-20 -123.89 109.66 13.88 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.718 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -87.25 149.72 24.39 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.067 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.718 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.07 HD11 ' HB2' ' A' ' 19' ' ' GLU . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.678 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.831 ' O ' HG23 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 69.8 mtt180 -62.39 -40.54 96.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.554 ' HE2' HG12 ' A' ' 31' ' ' VAL . 41.8 m-85 -59.96 -40.66 89.81 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.883 0.373 . . . . 0.0 110.907 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -67.23 -40.0 86.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.6 t -62.95 -39.95 96.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.169 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 52.0 m-85 -65.73 -47.56 74.89 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -61.67 -38.12 86.59 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.599 177.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -42.65 94.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.18 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -62.1 -40.45 95.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 66.4 t -65.68 -40.35 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.25 -43.91 95.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.514 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.03 -48.19 82.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.735 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -59.91 -40.13 87.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.802 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.61 -178.32 45.25 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.851 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -76.39 115.93 16.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.007 0.432 . . . . 0.0 110.781 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 41.9 mtmt -81.84 154.61 25.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.175 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 84.6 mt -155.4 -43.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 79.5 106.39 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.442 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -80.02 148.3 31.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.198 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.8 p -69.79 153.21 43.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 111.004 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.874 ' O ' HG23 ' A' ' 57' ' ' VAL . 94.0 m-85 -66.85 -22.7 65.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.452 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.459 ' HB2' ' NH2' ' A' ' 118' ' ' ARG . 75.9 m80 -60.05 -40.02 87.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.559 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.06 -45.26 93.45 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 53' ' ' TYR . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.617 ' HZ ' HG23 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.732 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.514 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.732 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.54 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.789 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.78 ' O ' HG22 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.825 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 76' ' ' LEU . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.987 HD13 HD23 ' A' ' 146' ' ' LEU . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.62 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.818 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.62 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m -63.9 -46.22 85.82 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.0 -48.54 81.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.123 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -134.14 143.32 47.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.595 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.0 129.39 92.26 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.223 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.28 -166.14 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.458 2.106 . . . . 0.0 112.229 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.766 ' HB ' ' HA3' ' A' ' 89' ' ' GLY . 36.9 m -81.31 138.3 35.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.163 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 87' ' ' ILE . 80.8 m-20 -76.58 121.23 22.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.197 0.522 . . . . 0.0 111.298 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.639 ' N ' HD11 ' A' ' 154' ' ' LEU . 78.6 mt 70.79 -62.8 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.855 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.953 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 -60.11 -41.65 93.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.053 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.766 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.864 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.953 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.665 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.759 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.841 ' O ' HG23 ' A' ' 101' ' ' VAL . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.54 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 97' ' ' LEU . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.709 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.664 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.663 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.446 HD22 HD22 ' A' ' 65' ' ' LEU . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.679 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.44 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.812 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.679 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.459 ' NH2' ' HB2' ' A' ' 54' ' ' HIS . 20.8 ttm-85 -99.96 140.05 34.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -76.58 -20.39 56.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.411 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.649 HG21 ' CZ ' ' A' ' 115' ' ' ARG . 12.7 t 43.28 -171.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.907 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 98.4 mmm -150.68 159.99 44.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.33 123.76 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.498 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.533 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 85.6 t60 -62.96 -41.34 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.835 0.35 . . . . 0.0 110.432 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 57.1 m -60.14 -39.96 88.14 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.71 -24.25 48.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.583 ' HA ' ' NH2' ' A' ' 115' ' ' ARG . 58.3 t-80 -66.16 -42.4 89.06 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.763 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.18 -40.56 94.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.556 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -60.86 -42.56 98.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.275 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.812 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.411 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.851 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.698 ' O ' HD23 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.709 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.651 ' O ' HD13 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.779 HD13 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.709 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.987 HD23 HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.74 HG22 ' CD2' ' A' ' 94' ' ' HIS . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.709 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.826 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.864 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -70.03 -19.95 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.646 HD22 ' HD3' ' A' ' 90' ' ' LYS . 32.3 tp -67.88 -25.58 65.58 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.022 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 8.7 mp -69.11 137.03 53.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.369 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.85 -179.835 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.6 mtm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 59.95 37.07 21.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -76.1 142.79 41.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.685 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -85.98 117.93 69.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.758 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.5 135.7 50.85 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.465 2.11 . . . . 0.0 112.15 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -76.79 129.98 37.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.653 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -99.52 131.96 45.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.735 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 60.7 m -78.98 130.0 35.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.906 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 32.6 t -91.24 129.02 42.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.13 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.7 m -77.21 138.56 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.879 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -83.27 24.42 0.81 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -70.57 -40.02 73.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.5 m -73.46 133.0 43.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.218 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -88.7 132.14 11.07 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.594 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 36.2 Cg_endo -65.0 144.58 82.93 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.729 2.286 . . . . 0.0 112.371 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 97.9 mttt -158.41 120.07 3.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.83 133.22 30.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.173 0.511 . . . . 0.0 111.679 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 127.5 33.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.09 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.934 ' HG3' HD11 ' A' ' 24' ' ' ILE . 86.2 tt0 -122.42 109.72 14.74 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m -115.84 148.07 40.34 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.032 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.727 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.934 HD11 ' HG3' ' A' ' 19' ' ' GLU . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.678 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.781 ' O ' HG23 ' A' ' 31' ' ' VAL . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.678 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.46 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.46 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 -65.95 -39.91 90.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.708 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 65.2 t80 -59.92 -49.54 77.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.202 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 72.4 tp60 -63.12 -39.97 96.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.059 0.457 . . . . 0.0 110.77 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.6 t -61.23 -39.85 91.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.93 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.67 -50.22 74.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.708 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 23.2 mttm -62.87 -38.19 89.89 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.946 176.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.96 -41.9 92.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.703 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.23 -40.07 94.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.978 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.77 -41.76 90.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.809 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.42 -42.48 96.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.06 -44.53 94.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.923 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.2 ttt180 -59.96 -40.08 87.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.13 148.04 17.08 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.231 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -78.75 116.95 19.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.81 0.338 . . . . 0.0 110.703 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -89.46 118.99 29.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.454 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.491 ' HG ' ' HB2' ' A' ' 51' ' ' ASP . 46.2 tp -70.01 -40.04 75.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.957 0.408 . . . . 0.0 110.914 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 46.47 17.63 0.05 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.491 ' HB2' ' HG ' ' A' ' 49' ' ' LEU . 98.9 m-20 -90.32 -73.05 0.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.954 0.407 . . . . 0.0 111.253 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.1 p -70.0 134.39 48.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.247 0.546 . . . . 0.0 111.346 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 57' ' ' VAL . 6.4 t80 -65.66 -19.0 65.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.993 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.442 ' CB ' ' HD2' ' A' ' 118' ' ' ARG . 76.7 m80 -60.02 -38.63 83.24 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.049 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.95 -44.97 94.06 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 53' ' ' TYR . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.57 ' HA ' ' OD2' ' A' ' 61' ' ' ASP . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.575 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.744 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.916 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.773 ' O ' HG22 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.908 ' HD3' HD13 ' A' ' 143' ' ' LEU . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.916 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.627 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.627 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t -60.7 -41.16 94.63 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.42 ' HB3' ' OD2' ' A' ' 83' ' ' ASP . 66.2 m-85 -60.03 -39.99 87.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.699 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 62.06 19.97 11.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.108 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 4.5 m-20 -71.2 -59.2 3.46 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.572 0.225 . . . . 0.0 110.668 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 94.5 Cg_endo -82.98 151.84 14.27 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.688 2.259 . . . . 0.0 112.262 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.5 m -83.21 122.02 27.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.852 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -76.67 153.94 34.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.359 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.0 pt -155.08 -162.02 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.74 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 -59.93 -40.08 87.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.096 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HE2' ' HZ1' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' CD1' HD13 ' A' ' 154' ' ' LEU . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.809 ' O ' HG23 ' A' ' 101' ' ' VAL . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.673 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.744 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 97' ' ' LEU . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.745 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.692 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.746 ' CG ' HD11 ' A' ' 133' ' ' ILE . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 133' ' ' ILE . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD3' ' CD2' ' A' ' 126' ' ' HIS . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 54' ' ' HIS . 64.6 mtp85 -87.7 -171.45 3.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -77.91 133.82 38.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.857 0.361 . . . . 0.0 110.069 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.91 118.72 21.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.64 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 67.5 mtt -153.04 159.57 42.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.398 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 59.33 86.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.269 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.599 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 92.2 m-70 -63.3 -39.94 95.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.737 0.303 . . . . 0.0 111.078 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.7 t -59.94 -40.0 87.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.736 0.303 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.25 -23.84 57.39 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 60.6 m170 -67.25 -42.49 83.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.841 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -59.96 -42.34 93.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.625 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -60.57 -47.88 84.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.851 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.783 ' O ' HD13 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.746 HD11 ' CG ' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.739 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 65' ' ' LEU . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.739 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' TRP . . . . . 0.645 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.908 HD13 ' HD3' ' A' ' 72' ' ' LYS . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.457 HD21 HG11 ' A' ' 101' ' ' VAL . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.685 ' HZ1' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.716 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -68.5 -32.21 72.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.556 HD13 ' CD1' ' A' ' 91' ' ' TYR . 84.2 mt -69.29 -24.86 64.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.496 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 91.1 mt -62.8 132.45 52.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.912 0.387 . . . . 0.0 110.904 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.926 179.787 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 121.196 0.522 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 20' ' ' THR . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.602 ' O ' HG23 ' A' ' 31' ' ' VAL . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 27' ' ' ARG . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.57 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER . . . . . 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.815 ' CZ ' HG23 ' A' ' 129' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.038 ' HG ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.981 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.669 HD13 HD23 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.704 ' HA ' HG12 ' A' ' 73' ' ' VAL . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.935 ' HG2' HD22 ' A' ' 97' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.715 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.414 ' N ' HG13 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.844 HD11 ' HD3' ' A' ' 93' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.715 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.619 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.619 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.844 ' HD3' HD11 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.752 ' CE1' HG22 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.678 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.935 HD22 ' HG2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.678 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 97' ' ' LEU . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.94 ' HE3' HD22 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.743 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.636 HD12 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.623 HD21 ' CB ' ' A' ' 61' ' ' ASP . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.654 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.574 HG21 ' HB2' ' A' ' 58' ' ' PHE . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.631 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.57 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 . . . . . 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.815 HG23 ' CZ ' ' A' ' 58' ' ' PHE . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.631 ' HE3' ' HD2' ' A' ' 115' ' ' ARG . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.466 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.038 HD13 ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.637 ' CD1' HD11 ' A' ' 69' ' ' ILE . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.91 HD21 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.597 HD13 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.752 HG22 ' CE1' ' A' ' 94' ' ' HIS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 . . . . . 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 C--O 1.223 -0.309 0 CA-C-O 120.787 0.327 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.631 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.752 HG22 HH21 ' A' ' 27' ' ' ARG . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.752 HH21 HG22 ' A' ' 24' ' ' ILE . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 ttp85 . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 55' ' ' LEU . 2.8 tm? . . . . . 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 115' ' ' ARG . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.009 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.757 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.77 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.51 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.785 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 93' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 146' ' ' LEU . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 73' ' ' VAL . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 150' ' ' LYS . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.639 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.692 ' HE2' HD12 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.798 ' HA ' HD12 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.671 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.671 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.714 HG22 ' HH2' ' A' ' 68' ' ' TRP . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' GLU . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 1.009 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.759 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.838 ' HG3' HD11 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.762 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.762 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.761 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.761 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.442 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.838 HD11 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.902 HD13 HD23 ' A' ' 65' ' ' LEU . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.56 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.755 ' HA ' HD12 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.807 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.493 ' O ' HG13 ' A' ' 24' ' ' ILE . 17.2 m . . . . . 0 C--O 1.223 -0.3 0 CA-C-O 121.139 0.495 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.417 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.649 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.683 ' O ' HG23 ' A' ' 31' ' ' VAL . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.649 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 27' ' ' ARG . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp . . . . . 0 CA--C 1.512 -0.49 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.457 HG23 ' N ' ' A' ' 58' ' ' PHE . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.553 ' HZ ' HG23 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.734 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.728 HD12 HD13 ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.864 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 140' ' ' TRP . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.621 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.683 ' HE2' HD23 ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' N ' HG13 ' A' ' 73' ' ' VAL . 6.7 m120 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.652 HD11 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 146' ' ' LEU . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.518 ' HG2' HE21 ' A' ' 92' ' ' GLN . 64.0 tt0 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.474 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.666 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.592 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 75.3 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.799 ' O ' HD13 ' A' ' 97' ' ' LEU . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.666 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.799 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.685 ' O ' HG22 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.864 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . 0.5 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.708 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.742 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.686 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.686 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.829 0.347 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.553 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.734 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.709 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.728 HD13 HD12 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.709 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.71 ' CD1' HD11 ' A' ' 69' ' ' ILE . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.609 ' O ' HD13 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.645 HD21 ' HD2' ' A' ' 72' ' ' LYS . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.561 HD22 ' HZ3' ' A' ' 140' ' ' TRP . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 76' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.667 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.474 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.73 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m . . . . . 0 C--O 1.226 -0.132 0 CA-C-O 121.15 0.5 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.73 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.666 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.467 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.65 ' O ' HG23 ' A' ' 31' ' ' VAL . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 27' ' ' ARG . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD2' ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.62 ' HZ ' HG23 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HE3' ' CD2' ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 1.013 ' HA ' HD12 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.013 HD12 ' HA ' ' A' ' 62' ' ' ALA . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.628 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.937 HG23 HD11 ' A' ' 143' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.593 ' HA ' HG12 ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE2' HD13 ' A' ' 97' ' ' LEU . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.593 HG12 ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.585 HD21 HD12 ' A' ' 146' ' ' LEU . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HE2' HD12 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.638 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m . . . . . 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.609 ' NE2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 36.4 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.708 ' O ' HG23 ' A' ' 101' ' ' VAL . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.63 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . 0.507 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.644 ' HA ' ' OG1' ' A' ' 103' ' ' THR . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 97' ' ' LEU . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.644 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.576 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.658 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.445 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.793 0.33 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.62 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.689 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.471 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.01 HD21 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.651 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.794 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.937 HD11 HG23 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 142' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.609 HG22 ' NE2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.618 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.4 m . . . . . 0 C--O 1.225 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.487 ' HA ' HG22 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.489 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.618 HG22 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.489 ' N ' HG23 ' A' ' 24' ' ' ILE . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 31' ' ' VAL . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.804 ' O ' HD23 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 27' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 3.1 tm? . . . . . 0 CA--C 1.518 -0.261 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.0 HD22 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.768 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.52 HG23 ' CD2' ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.654 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.906 ' HD3' HD23 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.691 ' HA ' HD12 ' A' ' 76' ' ' LEU . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.681 HG21 ' CD2' ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 ' HE1' ' A' ' 94' ' ' HIS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.558 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.533 ' HZ3' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t . . . . . 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.595 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 . . . . . 0 C--O 1.228 -0.077 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.742 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.711 ' HE1' HD23 ' A' ' 76' ' ' LEU . 92.6 m-70 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.638 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.906 HD23 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.638 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 97' ' ' LEU . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 1.0 ' HE3' HD22 ' A' ' 65' ' ' LEU . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.779 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.622 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.779 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 114' ' ' THR . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.829 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.829 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.705 ' HD2' HG21 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 . . . . . 0 C--O 1.23 0.037 0 CA-C-O 120.738 0.304 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.705 HG21 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 111' ' ' LEU . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.78 HD13 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.675 ' NE1' HG13 ' A' ' 101' ' ' VAL . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.677 ' HA ' HD12 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.679 ' O ' HD23 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.677 HD12 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.679 HD23 ' O ' ' A' ' 144' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.533 ' HD2' ' HZ3' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.58 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.1 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.492 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.58 HG13 ' O ' ' A' ' 20' ' ' THR . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 62.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.412 ' O ' HG23 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 25' ' ' GLN . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.688 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.898 HD22 HD23 ' A' ' 136' ' ' LEU . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.676 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.733 HG23 HD22 ' A' ' 143' ' ' LEU . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.701 ' HA ' HG12 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.635 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.648 ' HD2' HD21 ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.701 HG12 ' HA ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.635 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.766 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.781 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.527 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.781 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t . . . . . 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.81 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.81 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.2 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HG23 ' A' ' 101' ' ' VAL . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.642 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.676 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.798 HG13 ' HE1' ' A' ' 140' ' ' TRP . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.833 ' HD3' HD12 ' A' ' 107' ' ' LEU . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.627 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 133' ' ' ILE . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.685 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.597 ' HG2' HG21 ' A' ' 129' ' ' THR . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 8.4 mtt-85 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.597 HG21 ' HG2' ' A' ' 115' ' ' ARG . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.556 ' O ' HD13 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 111' ' ' LEU . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.898 HD23 HD22 ' A' ' 65' ' ' LEU . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.798 ' HE1' HG13 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.453 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.733 HD22 HG23 ' A' ' 69' ' ' ILE . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.717 HD21 HG11 ' A' ' 101' ' ' VAL . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 143' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.914 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.914 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.658 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.183 0.516 . . . . 0.0 111.643 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.658 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 20' ' ' THR . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.59 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.739 ' O ' HG22 ' A' ' 31' ' ' VAL . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.6 ' HA ' ' CG2' ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 27' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.498 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.562 ' HB2' ' NE ' ' A' ' 118' ' ' ARG . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.415 ' N ' ' O ' ' A' ' 56' ' ' GLN . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.889 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.452 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.644 HD12 HD13 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.862 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.94 HG23 HD11 ' A' ' 143' ' ' LEU . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.459 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.902 ' HD2' HD11 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 1.123 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.853 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.757 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.853 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.465 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.814 ' HA ' ' HE2' ' A' ' 93' ' ' LYS . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 1.123 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.741 ' CE1' HG22 ' A' ' 147' ' ' THR . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.705 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 98.1 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.902 HD11 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.889 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.862 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.889 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.47 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.709 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.683 HD23 HD12 ' A' ' 133' ' ' ILE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.461 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.562 ' NE ' ' HB2' ' A' ' 58' ' ' PHE . 85.1 mtt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.764 0.316 . . . . 0.0 111.518 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.422 ' HG1' ' HE2' ' A' ' 58' ' ' PHE . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 135' ' ' GLU . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.889 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.683 HD12 HD23 ' A' ' 111' ' ' LEU . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.644 HD13 HD12 ' A' ' 65' ' ' LEU . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.47 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.73 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.94 HD11 HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.685 HD21 HG11 ' A' ' 101' ' ' VAL . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.744 HD13 ' CD2' ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.751 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.751 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.7 ' O ' HG22 ' A' ' 24' ' ' ILE . 2.9 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.86 0.362 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 25' ' ' GLN . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.529 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.657 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.7 HG22 ' O ' ' A' ' 20' ' ' THR . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.648 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 7.8 tt . . . . . 0 CA--C 1.517 -0.308 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.521 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.628 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.659 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.655 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.848 HD23 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.783 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.747 ' HA ' HG12 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.631 ' HD2' ' O ' ' A' ' 68' ' ' TRP . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.747 HG12 ' HA ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.668 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.445 ' CD2' HD13 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.641 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.668 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t . . . . . 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.561 ' HZ1' ' HG3' ' A' ' 150' ' ' LYS . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.707 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.592 ' CD2' HG22 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 101' ' ' VAL . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.657 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.783 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.766 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.739 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.62 HD12 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.739 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.575 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 . . . . . 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.635 0.255 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.658 ' NE2' HD11 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.488 HG23 ' HE2' ' A' ' 108' ' ' MET . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.848 HD13 HD23 ' A' ' 65' ' ' LEU . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.504 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 146' ' ' LEU . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.552 HD21 HG11 ' A' ' 101' ' ' VAL . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.77 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.422 ' HA2' ' NZ ' ' A' ' 90' ' ' LYS . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 . . . . . 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.718 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 121.337 0.589 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.718 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 20' ' ' THR . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.678 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.831 ' O ' HG23 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp . . . . . 0 CA--C 1.515 -0.399 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.617 ' HZ ' HG23 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.732 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.514 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.732 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.54 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.789 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.78 ' O ' HG22 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.825 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 76' ' ' LEU . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.987 HD13 HD23 ' A' ' 146' ' ' LEU . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.62 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.818 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.62 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m . . . . . 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.953 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 93' ' ' LYS . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.864 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.953 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.665 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.759 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.841 ' O ' HG23 ' A' ' 101' ' ' VAL . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.54 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 97' ' ' LEU . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.709 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.664 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.663 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.446 HD22 HD22 ' A' ' 65' ' ' LEU . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.679 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.44 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.812 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.679 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.8 ttm-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 . . . . . 0 CA--C 1.523 -0.069 0 CA-C-O 120.57 0.224 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.812 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.411 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.851 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.698 ' O ' HD23 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.709 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.651 ' O ' HD13 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.779 HD13 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.709 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.987 HD23 HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.74 HG22 ' CD2' ' A' ' 94' ' ' HIS . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.709 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.826 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . 0.864 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m . . . . . 0 N--CA 1.46 0.056 0 CA-C-O 121.293 0.568 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.727 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 20' ' ' THR . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.678 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.781 ' O ' HG23 ' A' ' 31' ' ' VAL . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.678 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.46 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.46 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.57 ' HA ' ' OD2' ' A' ' 61' ' ' ASP . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.575 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.744 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.916 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.773 ' O ' HG22 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.908 ' HD3' HD13 ' A' ' 143' ' ' LEU . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.916 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.627 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.627 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t . . . . . 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.465 0.174 . . . . 0.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HE2' ' HZ1' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' NE2' ' A' ' 95' ' ' GLN . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.809 ' O ' HG23 ' A' ' 101' ' ' VAL . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.673 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.744 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 97' ' ' LEU . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.745 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.692 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.746 ' CG ' HD11 ' A' ' 133' ' ' ILE . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 133' ' ' ILE . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.783 ' O ' HD13 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.746 HD11 ' CG ' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.739 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 65' ' ' LEU . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.739 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' TRP . . . . . 0.645 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.908 HD13 ' HD3' ' A' ' 72' ' ' LYS . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.457 HD21 HG11 ' A' ' 101' ' ' VAL . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.685 ' HZ1' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 . . . . . 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.815 0.341 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -70.02 -35.85 74.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -72.8 147.43 45.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.405 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 65.6 t80 -85.67 128.69 57.78 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 4' ' ' PHE . 10.6 Cg_exo -71.05 133.91 24.19 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.685 2.257 . . . . 0.0 112.349 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.74 139.98 42.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -98.08 120.02 37.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.889 0.376 . . . . 0.0 110.804 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.5 m -81.04 129.59 34.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.75 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' ' HB2' ' A' ' 12' ' ' SER . 18.8 t -91.89 128.25 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.448 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.7 t -78.87 127.34 39.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 111.856 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 60.04 27.25 16.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.449 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 9' ' ' VAL . 17.2 t -73.96 -42.07 61.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.502 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.8 m -78.27 -7.11 56.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.146 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.04 76.56 0.41 Allowed Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.031 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.92 126.37 11.85 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.597 2.198 . . . . 0.0 111.593 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 15.0 ttmt -80.05 100.63 8.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.142 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -80.45 131.81 33.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.718 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.6 mt -77.65 108.95 11.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 111.11 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' HD11 ' A' ' 24' ' ' ILE . 99.7 mt-10 -122.78 110.04 14.97 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.6 m -82.69 158.51 22.91 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.584 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -62.2 -47.85 82.62 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.8 mt-10 -70.89 -42.55 69.83 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.181 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.9 mt-10 -61.07 -47.32 86.88 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.227 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.579 HD11 ' HB3' ' A' ' 19' ' ' GLU . 86.1 mt -68.38 -45.11 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.3 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 28' ' ' ARG . 56.9 tt0 -59.98 -41.22 91.51 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.3 mt-10 -61.31 -47.51 85.6 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.602 ' O ' HG23 ' A' ' 31' ' ' VAL . 76.1 ttt-85 -62.73 -35.72 80.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.799 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 25' ' ' GLN . 16.9 tpt180 -60.06 -44.51 94.65 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -60.04 -42.14 93.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.399 . . . . 0.0 111.195 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -61.12 -43.25 99.17 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.36 0.6 . . . . 0.0 110.919 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 27' ' ' ARG . 69.8 t -60.04 -42.85 91.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.115 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -60.03 -45.08 93.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.01 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -65.51 -41.78 92.81 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.319 0.58 . . . . 0.0 110.17 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.6 ' HG2' ' HE2' ' A' ' 38' ' ' PHE . 59.8 ttt85 -62.11 -40.04 94.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.519 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.49 -40.92 84.11 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.159 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 73.1 tp60 -59.96 -42.15 93.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.925 0.393 . . . . 0.0 110.064 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.489 ' HA ' ' OE1' ' A' ' 40' ' ' GLU . 39.7 t -61.54 -40.05 93.28 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.384 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.6 ' HE2' ' HG2' ' A' ' 34' ' ' ARG . 38.4 m-85 -61.84 -45.99 91.4 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -60.26 -39.12 85.64 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.559 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 47.8 mt-10 -59.98 -40.12 88.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.25 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.4 -40.03 89.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.207 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 38' ' ' PHE . 76.6 t -60.0 -41.56 86.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.17 -178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.65 94.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.18 0.514 . . . . 0.0 110.975 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.04 -39.81 87.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.197 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 -58.2 -40.03 80.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.619 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -49.2 94.81 0.01 OUTLIER Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.814 -0.708 . . . . 0.0 113.046 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 120.18 23.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 0.0 110.776 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -89.86 120.03 30.74 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 3.4 mm? 56.64 101.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.884 178.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 -162.36 -102.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.642 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -85.83 113.68 22.18 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-O 120.928 0.394 . . . . 0.0 111.204 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.5 m -70.04 150.02 47.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.334 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 57' ' ' VAL . 55.1 p90 -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.137 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.469 ' CE1' ' CZ ' ' A' ' 53' ' ' TYR . 75.1 m80 -59.97 -39.89 87.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.181 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.57 HD23 ' NH1' ' A' ' 118' ' ' ARG . 0.9 OUTLIER -60.0 -42.34 94.06 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.357 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 94.6 mt-30 -67.26 -35.73 80.13 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.557 177.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 53' ' ' TYR . 91.7 t -62.36 -45.91 97.66 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.815 ' CZ ' HG23 ' A' ' 129' ' ' THR . 74.1 t80 -60.03 -40.03 87.91 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.901 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 19.5 tttm -62.15 -39.88 94.08 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.189 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 56' ' ' GLN . 24.9 mmt180 -64.81 -40.08 94.64 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.765 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 111' ' ' LEU . 95.9 m-20 -61.51 -39.82 92.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.62 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.09 -41.86 93.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.238 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.12 -43.45 70.98 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 76.5 m-20 -61.02 -36.12 78.68 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.461 -1.245 . . . . 0.0 109.299 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.038 ' HG ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.98 -49.7 76.63 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.939 -179.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 70' ' ' MET . . . -68.77 -35.99 81.31 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 64' ' ' ASP . 37.8 tttt -60.04 -45.82 91.57 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.129 -0.536 . . . . 0.0 111.886 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.981 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 84.1 t90 -60.12 -41.44 92.62 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.682 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.669 HD13 HD23 ' A' ' 143' ' ' LEU . 33.7 mm -66.97 -39.95 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-O 121.553 0.692 . . . . 0.0 109.318 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.704 ' HA ' HG12 ' A' ' 73' ' ' VAL . 66.5 mtt -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.785 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -68.7 -49.54 58.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.319 0.581 . . . . 0.0 109.922 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.935 ' HG2' HD22 ' A' ' 97' ' ' LEU . 61.5 mttt -64.55 -39.88 94.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.872 178.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.715 ' HA ' HD12 ' A' ' 76' ' ' LEU . 13.1 p -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.132 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.414 ' N ' HG13 ' A' ' 73' ' ' VAL . 10.3 m120 -65.47 -44.65 86.49 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.783 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.844 HD11 ' HD3' ' A' ' 93' ' ' LYS . 20.3 tt -64.25 -36.9 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.715 HD12 ' HA ' ' A' ' 73' ' ' VAL . 28.7 mt -62.18 -41.09 97.99 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.619 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.3 m -68.91 -34.9 76.16 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.603 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.472 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 95.4 m-20 -60.01 -45.58 92.31 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.556 -178.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 62.7 pttt -61.51 -25.11 67.06 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.619 ' HB2' ' O ' ' A' ' 77' ' ' THR . 52.1 m -61.7 -40.08 93.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.969 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.472 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 88.0 m-85 -59.95 -43.5 94.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.983 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -151.93 154.29 35.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -113.27 103.49 55.55 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.55 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.568 ' HD2' ' HE2' ' A' ' 90' ' ' LYS . 52.0 Cg_exo -51.58 142.0 41.1 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.582 2.188 . . . . 0.0 111.864 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.9 m -72.77 -39.99 66.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -77.01 123.3 26.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.203 0.525 . . . . 0.0 111.414 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.99 -39.93 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.177 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -58.55 -30.05 66.84 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 111.612 0.226 . . . . 0.0 111.612 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.7 -49.28 69.93 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.793 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.568 ' HE2' ' HD2' ' A' ' 84' ' ' PRO . 54.5 mttm -61.86 -40.34 95.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.055 0.455 . . . . 0.0 110.468 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.855 ' HA ' HD13 ' A' ' 154' ' ' LEU . 64.0 t80 -61.09 -40.0 92.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.825 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.0 -40.64 89.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.665 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.844 ' HD3' HD11 ' A' ' 75' ' ' ILE . 77.9 mttt -60.03 -40.06 88.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.192 0.52 . . . . 0.0 109.686 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.752 ' CE1' HG22 ' A' ' 147' ' ' THR . 86.3 t60 -59.99 -42.45 94.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.699 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.678 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.7 mt-30 -60.29 -46.31 90.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.284 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.6 m -60.05 -43.33 95.45 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.514 0.674 . . . . 0.0 110.447 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.935 HD22 ' HG2' ' A' ' 72' ' ' LYS . 2.4 mt -70.47 -19.95 62.91 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.049 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.678 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -62.84 -44.61 95.68 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.194 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.23 -37.67 83.97 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.508 177.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.981 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.0 -39.93 93.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.08 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 97' ' ' LEU . 60.5 t -61.06 -51.78 69.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 121.75 0.786 . . . . 0.0 109.285 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -62.55 -39.73 94.57 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.364 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.7 m -65.35 -45.71 83.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.959 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.94 ' HE3' HD22 ' A' ' 65' ' ' LEU . 36.9 tptt -60.12 -39.93 87.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.397 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.743 ' O ' ' HB2' ' A' ' 108' ' ' MET . 67.4 m -59.37 -39.47 83.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.318 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 109' ' ' SER . 39.6 ttm180 -62.39 -39.57 93.65 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.527 0.68 . . . . 0.0 109.529 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.636 HD12 ' HD2' ' A' ' 104' ' ' LYS . 84.8 mt -59.87 -30.9 69.3 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 176.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.743 ' HB2' ' O ' ' A' ' 105' ' ' SER . 67.8 mtt -67.31 -36.84 82.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 176.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 72.9 m -64.61 -49.38 71.33 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.667 -1.151 . . . . 0.0 108.947 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -62.3 -39.98 94.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.039 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.623 HD21 ' CB ' ' A' ' 61' ' ' ASP . 59.2 mt -60.09 -40.02 88.15 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.584 179.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.17 -46.57 80.3 Favored 'General case' 0 CA--C 1.511 -0.519 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.654 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 63.0 mttm -60.01 -38.53 82.91 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.612 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.574 HG21 ' HB2' ' A' ' 58' ' ' PHE . 94.3 m -59.94 -39.83 86.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.951 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.631 ' HD2' ' HE3' ' A' ' 130' ' ' LYS . 34.1 ttp-105 -59.92 -42.77 94.67 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.01 -33.2 73.27 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.9 mt-10 -59.97 -32.46 70.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.707 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.57 ' NH1' HD23 ' A' ' 55' ' ' LEU . 52.7 ttt85 -59.0 144.07 46.32 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.356 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -80.04 160.07 25.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.414 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 121' ' ' MET . 13.4 t -75.57 -170.09 1.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.819 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . 0.504 ' HB2' ' O ' ' A' ' 120' ' ' THR . 66.3 mtt 70.68 13.41 7.25 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.784 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -144.24 60.05 0.51 Allowed Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.635 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 77.5 m80 -64.66 -40.04 94.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 111.163 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.0 p -61.77 -39.99 93.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.863 0.363 . . . . 0.0 110.988 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.449 ' HB1' ' NH2' ' A' ' 118' ' ' ARG . . . -60.06 -23.44 63.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' A' ' 123' ' ' HIS . 53.1 t-80 -66.02 -44.33 85.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.017 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.416 ' HA ' ' OE1' ' A' ' 127' ' ' GLU . 7.7 mm-40 -60.65 -42.25 96.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.472 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.69 -40.0 95.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.964 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.815 HG23 ' CZ ' ' A' ' 58' ' ' PHE . 94.6 m -66.42 -44.41 83.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.91 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.631 ' HE3' ' HD2' ' A' ' 115' ' ' ARG . 28.4 mmtp -60.01 -41.66 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.776 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.04 -41.01 74.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.85 0.357 . . . . 0.0 111.516 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.466 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 80.0 t60 -59.99 -44.23 94.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.409 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 14.1 tt -69.88 -40.0 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.383 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 46.0 mt-10 -61.24 -40.03 92.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.664 0.268 . . . . 0.0 111.444 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -67.68 -40.02 84.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.212 0.529 . . . . 0.0 110.696 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.038 HD13 ' HG ' ' A' ' 65' ' ' LEU . 87.5 mt -64.23 -40.05 95.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.839 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 137' ' ' ARG . 21.8 ttt180 -62.29 -39.93 94.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -63.87 -44.42 93.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 109.954 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.27 -40.18 86.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.132 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.637 ' CD1' HD11 ' A' ' 69' ' ' ILE . 1.3 t90 -62.11 -40.93 97.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.221 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.03 -43.37 95.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.231 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 146' ' ' LEU . 8.6 tt -59.9 -48.75 80.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.91 HD21 ' HB2' ' A' ' 72' ' ' LYS . 54.9 tp -61.61 -40.16 93.84 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.026 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.92 -49.93 75.77 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.15 -39.91 88.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.477 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.597 HD13 ' O ' ' A' ' 142' ' ' LEU . 5.4 mp -62.13 -41.32 98.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.154 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.752 HG22 ' CE1' ' A' ' 94' ' ' HIS . 93.3 m -67.36 -46.17 74.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.251 -0.886 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.47 -38.24 86.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.341 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -45.16 93.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.711 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 147' ' ' THR . 43.0 pttt -68.89 -39.95 79.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.982 0.42 . . . . 0.0 110.42 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.679 ' HA2' HD12 ' A' ' 154' ' ' LEU . . . -60.08 -32.27 75.37 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.308 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.0 -45.15 93.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.361 0.601 . . . . 0.0 109.479 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -68.22 -32.53 72.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.738 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.855 HD13 ' HA ' ' A' ' 91' ' ' TYR . 83.6 mt -69.28 -25.69 64.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.056 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 58.8 tp -67.07 130.2 42.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.943 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.257 -0.877 . . . . 0.0 110.854 -179.955 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 1' ' ' MET . 57.6 ttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.761 0.315 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -81.13 -10.16 59.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -78.38 146.54 34.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.869 0.366 . . . . 0.0 111.109 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -85.9 141.05 35.37 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.589 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 132.98 33.82 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.213 1.942 . . . . 0.0 111.961 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -167.38 140.91 3.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.661 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.53 131.87 42.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.444 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.4 m -80.0 135.07 36.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.152 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.4 m -88.3 122.33 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.882 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.4 p -81.43 124.58 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.009 0.433 . . . . 0.0 111.149 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -79.03 146.37 33.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.517 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.1 m -70.23 -40.07 74.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.771 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.7 m -78.46 129.23 34.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -167.21 55.29 0.23 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.884 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.29 117.3 4.33 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.248 1.965 . . . . 0.0 111.915 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.9 mttt 59.41 45.57 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.556 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 14' ' ' GLY . 41.1 t -75.38 130.02 36.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.058 0.456 . . . . 0.0 111.221 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.6 mt -75.97 145.56 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.12 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -120.98 110.32 16.14 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -85.39 149.44 25.42 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.206 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 24' ' ' ILE . . . -62.97 -46.86 85.69 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 49.8 mt-10 -70.07 -39.93 75.33 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.044 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.631 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.55 -47.83 84.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.539 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.752 HG22 HH21 ' A' ' 27' ' ' ARG . 49.7 pt -69.08 -42.25 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.96 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 29.9 tt0 -60.01 -37.47 79.8 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.372 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.25 -43.42 96.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.752 HH21 HG22 ' A' ' 24' ' ' ILE . 29.2 mtm105 -67.32 -36.82 82.25 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 176.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 78.2 mtp85 -59.97 -41.69 92.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.469 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -60.25 -39.98 88.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.5 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.82 -40.13 91.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.149 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.97 -45.44 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.399 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.23 -41.22 92.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.249 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.1 m -63.59 -40.21 96.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.732 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.506 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 27.2 ttp85 -59.98 -40.4 88.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.882 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.95 -43.68 94.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.991 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -65.17 -39.92 93.58 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.654 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 33.7 t -60.66 -39.9 90.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.059 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.506 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 10.0 m-85 -60.71 -49.56 77.01 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.5 ttpt -61.31 -39.94 92.32 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 45.4 mt-10 -62.25 -39.99 94.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.344 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 37' ' ' SER . 97.6 mtt180 -66.23 -39.94 89.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 34.1 m -69.64 -40.27 79.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.28 -48.71 78.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.045 0.45 . . . . 0.0 111.535 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.96 -43.71 94.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.495 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.674 ' HD3' ' HD2' ' A' ' 48' ' ' LYS . 40.7 ttm180 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.725 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 70.27 -153.89 52.18 Favored Glycine 0 C--N 1.329 0.149 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -76.84 118.24 19.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.057 0.456 . . . . 0.0 110.433 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.674 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 9.6 mtpm? -81.53 152.32 27.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.674 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.591 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 83.6 mt -80.05 -13.32 59.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.266 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.8 mt-10 80.45 -44.09 0.24 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 122.677 0.391 . . . . 0.0 111.077 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -152.98 107.48 3.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.553 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -70.01 141.69 52.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.842 ' O ' HG23 ' A' ' 57' ' ' VAL . 69.3 m-85 -64.44 -20.01 65.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.307 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.428 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 69.1 m80 -59.96 -38.9 83.84 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.519 ' HB2' ' HE2' ' A' ' 119' ' ' PHE . 2.8 tm? -60.07 -44.95 94.39 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 93.7 mt-30 -64.86 -35.88 82.55 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.604 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 53' ' ' TYR . 94.8 t -62.04 -43.68 97.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 115' ' ' ARG . 56.2 t80 -60.11 -40.01 88.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 176.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 17.9 mmtt -63.1 -40.03 96.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.429 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -63.47 -41.14 98.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -60.12 -39.95 88.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.942 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.43 -40.97 93.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.324 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -63.87 -51.49 64.36 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 91.9 m-20 -61.0 -38.17 85.12 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.031 177.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.009 HD12 ' HE3' ' A' ' 104' ' ' LYS . 9.3 tp -60.27 -49.54 77.2 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.58 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.64 -32.66 84.92 Favored Glycine 0 N--CA 1.438 -1.217 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.402 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 84.3 tttt -60.05 -41.75 92.98 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.217 0.532 . . . . 0.0 110.677 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.757 ' CH2' ' HE3' ' A' ' 72' ' ' LYS . 71.8 t90 -59.86 -39.68 86.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.672 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.77 ' O ' HG23 ' A' ' 73' ' ' VAL . 89.9 mt -60.11 -39.92 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-O 120.887 0.375 . . . . 0.0 110.097 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.51 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 98.1 mtp -59.79 -34.74 73.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -60.17 -48.45 81.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.785 ' HE2' ' HB3' ' A' ' 97' ' ' LEU . 6.9 mmtp -60.06 -35.32 74.89 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.164 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 69' ' ' ILE . 42.3 t -62.82 -42.67 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.078 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -61.93 -49.88 74.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.526 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 93' ' ' LYS . 15.3 tt -63.73 -36.84 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 146' ' ' LEU . 3.0 tm? -60.59 -42.35 96.56 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.062 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 73' ' ' VAL . 48.7 p -70.04 -30.3 67.55 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.048 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 96.7 m-20 -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.875 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.791 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 51.6 pttt -62.85 -25.51 68.31 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 77' ' ' THR . 31.7 t -62.19 -39.79 93.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.199 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.715 ' HD2' ' HG3' ' A' ' 82' ' ' GLU . 64.8 t80 -58.52 -43.43 89.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.014 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.715 ' HG3' ' HD2' ' A' ' 81' ' ' TYR . 64.1 mt-10 -115.07 143.27 45.45 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.741 0.305 . . . . 0.0 110.944 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.479 ' N ' ' HD3' ' A' ' 84' ' ' PRO . 2.4 t70 -121.43 51.26 2.55 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.447 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.577 ' HD3' ' HB3' ' A' ' 82' ' ' GLU . 79.7 Cg_endo -84.53 149.5 11.49 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.688 2.258 . . . . 0.0 111.842 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.1 m -83.3 -73.12 0.42 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.866 0.365 . . . . 0.0 110.682 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.7 121.89 24.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.599 HG23 ' O ' ' A' ' 87' ' ' ILE . 7.4 tt -162.74 89.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.448 0.642 . . . . 0.0 111.649 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 96.4 mt-30 -60.56 -39.93 89.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.525 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.39 -52.56 30.27 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.69 -177.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 150' ' ' LYS . 52.6 tttp -59.8 -39.98 86.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.094 0.447 . . . . 0.0 110.341 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.639 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 62.6 t80 -59.97 -40.78 90.27 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-O 121.268 0.556 . . . . 0.0 109.989 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 76.9 mt-30 -64.15 -39.88 94.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.355 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.692 ' HE2' HD12 ' A' ' 75' ' ' ILE . 87.6 tttt -59.64 -47.43 85.63 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.798 ' HA ' HD12 ' A' ' 97' ' ' LEU . 19.6 p80 -68.24 -39.6 82.23 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.978 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.671 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.0 tt0 -60.06 -44.07 94.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.019 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.6 m -60.06 -40.19 88.6 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.44 0.638 . . . . 0.0 109.749 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 94' ' ' HIS . 2.6 mt -70.16 -20.25 63.15 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.813 178.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.671 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -61.71 -43.57 98.61 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.97 -36.78 85.51 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.356 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 97' ' ' LEU . 50.9 tp10 -61.45 -39.59 91.39 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 114.622 -1.172 . . . . 0.0 110.355 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.714 HG22 ' HH2' ' A' ' 68' ' ' TRP . 60.0 t -60.15 -47.36 92.35 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.01 -39.34 85.46 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.182 177.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' GLU . 94.9 m -64.18 -48.15 77.08 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 1.009 ' HE3' HD12 ' A' ' 65' ' ' LEU . 49.3 tptt -60.18 -39.82 87.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.265 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.759 ' O ' ' HB3' ' A' ' 108' ' ' MET . 51.6 p -58.45 -36.61 73.94 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.602 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 109' ' ' SER . 50.7 ttt-85 -61.31 -39.76 91.7 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.453 0.644 . . . . 0.0 109.456 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.0 tt -59.92 -31.98 70.34 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 175.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.838 ' HG3' HD11 ' A' ' 133' ' ' ILE . 64.0 ttp -67.43 -38.97 85.39 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.762 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 24.7 t -60.52 -48.59 81.09 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.59 -38.64 84.32 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 177.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 107' ' ' LEU . 58.5 tp -60.03 -40.25 88.69 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.006 -179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.762 ' HG2' ' O ' ' A' ' 109' ' ' SER . 14.5 pt-20 -68.84 -42.17 77.51 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.39 -36.86 79.06 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.771 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.2 m -59.94 -39.73 86.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.912 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.761 ' HD2' ' HB ' ' A' ' 129' ' ' THR . 23.0 mtm180 -60.01 -44.45 94.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 109.151 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.44 -32.39 72.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.677 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -60.0 -42.62 94.67 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.092 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -103.1 140.04 37.83 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.271 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.519 ' HE2' ' HB2' ' A' ' 55' ' ' LEU . 95.7 m-85 60.4 65.67 1.04 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.09 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.445 ' O ' ' HB2' ' A' ' 121' ' ' MET . 18.2 p -74.77 154.65 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.007 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' A' ' 120' ' ' THR . 97.3 mtp 67.73 10.4 7.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.509 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -101.39 93.77 1.17 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.979 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -67.65 -40.1 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.59 0.233 . . . . 0.0 111.235 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.9 m -63.49 -40.09 96.17 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.833 0.349 . . . . 0.0 111.192 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.59 -22.46 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.32 -42.85 82.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.256 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.49 -42.61 96.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.4 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -68.35 -42.57 79.05 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.169 0.509 . . . . 0.0 110.961 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.761 ' HB ' ' HD2' ' A' ' 115' ' ' ARG . 17.6 p -73.06 -42.05 63.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.273 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -59.8 -39.92 86.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.459 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.96 -42.36 90.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.267 -179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.442 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 66.1 t60 -59.97 -47.68 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.838 HD11 ' HG3' ' A' ' 108' ' ' MET . 5.0 tt -69.98 -35.59 64.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.44 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -59.96 -45.86 91.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.811 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.51 -42.29 96.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.067 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.902 HD13 HD23 ' A' ' 65' ' ' LEU . 78.4 mt -61.08 -40.03 92.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.761 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -61.38 -39.96 92.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.987 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -60.16 -40.62 90.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.801 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.81 -40.29 94.74 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.038 0.447 . . . . 0.0 110.133 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.56 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.33 -42.87 99.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.552 179.596 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -60.09 -44.34 94.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.673 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 63.4 tp -60.23 -49.6 76.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.907 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.755 ' HA ' HD12 ' A' ' 146' ' ' LEU . 91.3 mt -60.1 -40.04 88.25 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.553 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.35 -48.34 80.22 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.98 -39.71 86.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.56 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.807 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.7 mt -60.05 -40.3 88.94 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.35 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.87 -46.91 73.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.22 -38.59 83.84 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.596 -1.184 . . . . 0.0 109.099 177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -59.98 -44.27 94.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.823 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.565 ' HE3' ' HE3' ' A' ' 90' ' ' LYS . 38.8 tttm -59.9 -45.33 92.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.555 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.439 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -60.8 -36.61 92.21 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.046 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.93 -43.99 94.61 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.3 -31.75 70.45 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.613 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.515 HD13 ' HD2' ' A' ' 91' ' ' TYR . 10.3 tt -69.11 -26.39 64.89 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.811 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 88.9 mt -68.36 137.4 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.05 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.764 179.88 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 120.923 0.392 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -71.95 -30.06 64.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -76.0 129.53 37.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.035 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -86.28 114.5 57.8 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.05 135.06 12.08 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.561 2.174 . . . . 0.0 112.375 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.7 mtpt -75.63 134.6 40.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.719 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -100.03 124.36 45.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 71.7 p -79.93 135.59 36.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.4 m -84.95 132.66 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.216 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.8 t -80.7 129.99 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -77.23 145.32 37.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.733 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.1 m -79.71 -10.38 59.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.311 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.627 ' O ' ' HD3' ' A' ' 15' ' ' PRO . 38.1 p 49.61 41.78 22.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.569 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -87.19 102.96 2.83 Favored Glycine 0 CA--C 1.521 0.406 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.484 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.627 ' HD3' ' O ' ' A' ' 13' ' ' SER . 83.1 Cg_endo -80.4 146.16 17.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.746 2.297 . . . . 0.0 112.487 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.6 mttm 64.25 118.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.99 133.11 32.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.187 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 tp -75.48 131.37 40.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.424 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HB3' ' CG1' ' A' ' 24' ' ' ILE . 76.1 mm-40 -122.35 109.25 14.19 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.493 ' O ' HG13 ' A' ' 24' ' ' ILE . 17.2 m -81.03 161.33 24.26 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.854 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -61.97 -47.9 82.75 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -71.7 -40.13 69.73 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.256 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.417 ' CG ' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -61.94 -47.38 85.15 Favored 'General case' 0 CA--C 1.52 -0.181 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.769 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.649 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.2 mt -69.06 -41.59 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.146 177.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.0 tt0 -60.04 -40.03 87.95 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.789 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -49.74 76.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.683 ' O ' HG23 ' A' ' 31' ' ' VAL . 59.1 ttt-85 -60.04 -38.61 83.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.928 176.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.649 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 31.9 mmm-85 -60.07 -45.16 93.81 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.14 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.76 -43.26 98.25 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.667 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.0 -40.99 97.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 27' ' ' ARG . 87.6 t -59.94 -48.66 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.809 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.01 -40.26 88.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.641 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -64.48 -40.02 94.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.051 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -62.96 -42.03 99.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.502 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.428 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 39.4 m-85 -59.9 -44.45 94.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.8 0.333 . . . . 0.0 111.101 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.69 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.2 mt-30 -69.96 -40.53 75.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.922 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.449 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 67.6 m -60.99 -39.98 91.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.038 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.74 -49.56 77.0 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -61.16 -39.96 92.08 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 114.533 -1.212 . . . . 0.0 108.265 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.69 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.3 mt-10 -60.91 -41.42 96.08 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.29 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 37' ' ' SER . 60.5 mtp180 -60.02 -40.08 88.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.846 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.824 HG13 ' NH2' ' A' ' 45' ' ' ARG . 78.1 t -65.45 -47.87 85.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.07 94.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.68 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.6 mt-10 -59.97 -40.08 87.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.939 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.824 ' NH2' HG13 ' A' ' 42' ' ' VAL . 28.5 mtm105 -59.91 -40.11 87.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.591 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 56.99 -161.68 7.76 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.567 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -78.23 116.39 18.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.871 0.367 . . . . 0.0 110.613 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -84.65 149.47 25.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.11 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 61.8 tp -69.93 -40.03 75.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.444 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.634 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 48.7 mt-10 87.57 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.011 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -83.61 164.61 19.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.876 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 m -69.62 123.92 22.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.67 ' O ' HG13 ' A' ' 57' ' ' VAL . 2.2 t80 -60.09 -19.78 54.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.516 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.564 ' HA ' HG22 ' A' ' 57' ' ' VAL . 74.4 m80 -60.75 -41.29 95.12 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 3.1 tp -69.95 -47.56 61.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.658 0.742 . . . . 0.0 109.841 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.2 mm100 -64.81 -38.39 90.82 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.432 -1.258 . . . . 0.0 110.842 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 53' ' ' TYR . 15.5 m -65.52 -42.84 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.026 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.462 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.553 ' HZ ' HG23 ' A' ' 129' ' ' THR . 67.1 t80 -59.98 -37.15 78.8 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 96.4 mttt -67.89 -40.39 83.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.275 178.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 51.4 mtt180 -65.88 -39.97 91.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.133 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.0 -40.06 87.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.7 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.734 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -60.5 -43.84 96.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.151 0.5 . . . . 0.0 111.058 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -70.95 -49.52 44.6 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.658 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 67' ' ' LYS . 85.0 m-20 -60.04 -36.85 78.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.745 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.728 HD12 HD13 ' A' ' 136' ' ' LEU . 2.3 tm? -60.03 -48.97 79.5 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.352 -0.84 . . . . 0.0 108.81 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.49 -33.38 76.81 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 86.1 tttt -60.11 -42.56 95.0 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.138 -0.531 . . . . 0.0 110.434 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.864 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 86.4 t90 -59.92 -40.0 87.37 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.88 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 140' ' ' TRP . 34.4 mm -64.9 -39.96 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.258 0.551 . . . . 0.0 109.851 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.621 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.8 mtm -60.07 -35.38 75.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -71.04 -51.11 27.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.526 0.679 . . . . 0.0 109.971 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.683 ' HE2' HD23 ' A' ' 97' ' ' LEU . 13.1 ttmm -62.64 -39.99 95.62 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.597 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.657 ' O ' HG23 ' A' ' 77' ' ' THR . 14.8 p -67.1 -43.03 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 111.588 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' N ' HG13 ' A' ' 73' ' ' VAL . 6.7 m120 -60.32 -48.76 80.37 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.652 HD11 ' HD3' ' A' ' 93' ' ' LYS . 18.7 tt -64.22 -37.12 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 146' ' ' LEU . 40.7 tp -61.31 -41.63 97.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.45 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 73' ' ' VAL . 71.2 p -70.06 -29.42 66.42 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 177.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.4 m-20 -60.12 -41.49 92.74 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.143 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 52.7 pttt -63.01 -25.45 68.39 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 77' ' ' THR . 19.4 t -62.01 -47.1 86.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.98 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.537 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 64.4 t80 -60.02 -48.69 80.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.022 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.537 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 40.1 mt-10 -138.61 155.53 48.24 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.767 0.318 . . . . 0.0 110.817 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -130.3 75.49 79.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.654 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD2' ' NZ ' ' A' ' 90' ' ' LYS . 50.8 Cg_exo -52.16 147.19 28.25 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.273 1.982 . . . . 0.0 111.951 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 9.6 t -84.01 -3.57 58.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.349 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -77.09 108.49 10.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.979 0.418 . . . . 0.0 111.277 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.3 -39.9 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.674 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.518 ' HG2' HE21 ' A' ' 92' ' ' GLN . 64.0 tt0 -59.62 -40.05 86.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.87 -54.25 15.46 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 119.552 -1.309 . . . . 0.0 111.754 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.474 ' HD3' ' CE ' ' A' ' 150' ' ' LYS . 62.9 mttm -61.06 -40.01 92.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.931 0.396 . . . . 0.0 110.695 178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.666 ' HA ' ' CD2' ' A' ' 94' ' ' HIS . 60.4 t80 -60.08 -39.89 87.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.157 -178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.592 ' O ' ' HG2' ' A' ' 95' ' ' GLN . 75.3 mt-30 -66.3 -40.0 89.71 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.799 ' O ' HD13 ' A' ' 97' ' ' LEU . 34.1 mttm -60.02 -48.52 81.37 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.804 -178.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.666 ' CD2' ' HA ' ' A' ' 91' ' ' TYR . 10.0 p80 -70.05 -40.07 75.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 13.1 pt20 -59.98 -41.39 91.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.026 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.4 p -63.67 -43.41 96.79 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.497 0.665 . . . . 0.0 109.477 178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.799 HD13 ' O ' ' A' ' 93' ' ' LYS . 10.2 mp -69.95 -18.61 63.37 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.825 -1.079 . . . . 0.0 108.891 177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.685 ' O ' HG22 ' A' ' 101' ' ' VAL . 86.4 tt0 -63.36 -44.07 95.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.833 0.825 . . . . 0.0 108.865 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.98 -37.18 78.62 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.619 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.864 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.6 mt-10 -67.45 -40.08 85.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 114.655 -1.157 . . . . 0.0 112.023 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 98' ' ' GLU . 28.9 m -61.07 -48.18 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.504 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . 0.5 ' N ' HG23 ' A' ' 101' ' ' VAL . 61.1 tt0 -61.18 -40.11 92.68 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.596 -1.183 . . . . 0.0 108.867 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -60.92 -47.92 84.21 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.806 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.708 ' HG3' ' CD2' ' A' ' 68' ' ' TRP . 1.3 mmpp? -59.93 -40.21 88.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.153 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 108' ' ' MET . 22.8 t -60.01 -39.84 87.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.638 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.468 ' O ' ' HB3' ' A' ' 109' ' ' SER . 83.4 mtt180 -66.04 -39.95 90.59 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.218 0.532 . . . . 0.0 110.084 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 111' ' ' LEU . 9.8 mp -60.04 -29.18 68.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.742 ' HB2' ' O ' ' A' ' 105' ' ' SER . 98.1 mtp -69.64 -37.44 76.76 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 38.6 t -64.34 -50.48 67.59 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.011 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.9 -37.73 88.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.338 178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 108' ' ' MET . 11.6 mt -58.51 -40.07 81.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.578 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.23 -45.32 73.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.686 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 87.0 tttt -60.08 -37.56 80.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.099 177.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 117' ' ' GLU . 85.5 m -60.01 -38.91 84.03 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.91 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 tpt85 -59.58 -45.21 92.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 52.5 tp10 -69.13 -37.26 78.21 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.883 176.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.686 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 98.5 mt-10 -60.11 -42.35 94.51 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.054 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . 8.1 mtp-105 -103.64 140.01 38.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.02 0.438 . . . . 0.0 111.93 -179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.589 ' O ' ' HD1' ' A' ' 119' ' ' PHE . 0.1 OUTLIER -90.58 109.95 21.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.21 179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.39 118.98 24.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.744 0.307 . . . . 0.0 110.612 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 57.6 ttm -76.01 -40.08 54.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.759 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.26 7.06 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.796 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 81.9 t60 -66.65 -40.0 88.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.822 0.344 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 77.1 p -63.26 -39.78 95.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.568 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.61 -23.25 50.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 40.6 m170 -66.76 -42.58 85.92 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.58 -43.84 98.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.571 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -60.58 -44.95 95.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.004 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.553 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 94.5 m -64.0 -47.1 81.67 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.249 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 29.0 mtpp -59.96 -44.13 94.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -70.2 -40.82 74.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.734 ' NE2' ' HB1' ' A' ' 62' ' ' ALA . 82.3 t60 -60.06 -46.25 90.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.279 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 18.8 tt -70.04 -40.2 78.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.718 0.294 . . . . 0.0 111.293 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.3 mt-10 -61.79 -40.91 96.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.343 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.709 ' O ' HD23 ' A' ' 139' ' ' LEU . 98.9 mt-10 -65.21 -42.91 93.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.991 0.424 . . . . 0.0 110.488 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.728 HD13 HD12 ' A' ' 65' ' ' LEU . 88.0 mt -63.07 -40.04 96.5 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.178 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -62.31 -39.97 94.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.166 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -66.37 -46.51 76.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.817 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.709 HD23 ' O ' ' A' ' 135' ' ' GLU . 2.7 mm? -68.5 -40.05 81.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.171 0.51 . . . . 0.0 110.574 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.71 ' CD1' HD11 ' A' ' 69' ' ' ILE . 3.3 t90 -62.71 -41.43 99.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.252 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.02 -45.65 92.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.893 0.378 . . . . 0.0 111.069 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.609 ' O ' HD13 ' A' ' 146' ' ' LEU . 61.6 tp -59.92 -47.5 85.53 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.471 0.653 . . . . 0.0 110.461 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.645 HD21 ' HD2' ' A' ' 72' ' ' LYS . 58.2 tp -60.46 -39.93 89.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.897 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.561 HD22 ' HZ3' ' A' ' 140' ' ' TRP . 60.8 tp -60.17 -49.99 75.46 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.667 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.495 177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 76' ' ' LEU . 5.4 mp -59.7 -40.03 86.6 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.119 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.5 m -66.61 -45.1 80.22 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.07 -39.85 87.49 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.945 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.667 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 98.4 mt-10 -59.98 -40.06 87.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.914 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.474 ' CE ' ' HD3' ' A' ' 90' ' ' LYS . 56.0 tptt -63.37 -43.45 97.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.992 0.425 . . . . 0.0 111.274 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.776 ' HA2' HD12 ' A' ' 154' ' ' LEU . . . -60.3 -30.21 70.59 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.335 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -60.04 -44.35 94.71 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -69.98 -29.29 66.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.022 178.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.776 HD12 ' HA2' ' A' ' 151' ' ' GLY . 83.9 mt -69.43 -25.88 64.34 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.809 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 95.1 mt -67.7 130.18 42.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 110.9 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.142 180.0 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.8 mtm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.862 0.363 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -39.88 75.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.875 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -74.05 147.39 42.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 4.4 m-85 -85.83 129.44 54.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.097 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 4' ' ' PHE . 21.6 Cg_exo -65.18 149.92 88.23 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.562 2.175 . . . . 0.0 112.505 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -76.56 154.43 34.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.518 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 134.6 57.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.972 0.415 . . . . 0.0 110.797 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 t -81.59 133.68 35.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.572 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.98 135.72 24.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.518 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 m -73.65 129.31 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 121.116 0.484 . . . . 0.0 111.23 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -79.74 152.43 29.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.457 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -76.45 160.32 29.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.759 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.1 m -70.54 129.99 40.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.155 0.502 . . . . 0.0 111.132 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.85 -146.69 7.11 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.684 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.54 118.47 5.5 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.174 1.916 . . . . 0.0 111.566 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -81.55 26.68 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.7 t -77.84 113.4 16.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.852 0.358 . . . . 0.0 110.586 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.9 tp -78.56 118.48 20.72 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.803 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.765 ' HG3' HD11 ' A' ' 24' ' ' ILE . 86.1 tt0 -123.0 108.97 13.52 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.73 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.3 m -92.16 149.77 21.29 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.479 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.92 -47.52 77.45 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 50.8 mt-10 -70.01 -40.76 75.06 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.106 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.73 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 85.6 tt0 -60.27 -48.12 83.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.759 178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 19' ' ' GLU . 44.0 mm -69.53 -40.1 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.161 177.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.467 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 64.0 tt0 -59.84 -39.21 84.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.056 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.04 -47.14 87.1 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.65 ' O ' HG23 ' A' ' 31' ' ' VAL . 84.1 mtt85 -65.84 -37.33 85.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 24' ' ' ILE . 23.6 mmm180 -60.18 -40.65 90.75 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.885 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -59.97 -44.48 94.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.836 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 33' ' ' THR . 96.4 mt-10 -65.09 -41.07 95.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.175 0.512 . . . . 0.0 110.768 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 27' ' ' ARG . 80.2 t -60.06 -43.15 92.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.919 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.04 -49.42 77.72 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.733 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 30' ' ' GLU . 13.7 t -63.28 -42.98 99.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.845 0.355 . . . . 0.0 111.056 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -65.93 -40.02 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.554 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 61.4 t80 -59.93 -41.07 91.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.77 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 66.9 tt0 -59.96 -39.99 87.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.103 0.477 . . . . 0.0 110.334 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 71.3 m -60.36 -38.12 82.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -60.2 -46.11 90.84 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 95.3 mttt -61.11 -38.29 85.81 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.97 -1.014 . . . . 0.0 108.848 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' HB3' ' O ' ' A' ' 37' ' ' SER . 86.5 tt0 -60.05 -40.42 89.34 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.616 -179.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -60.31 -40.32 90.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 64.2 t -61.32 -42.3 93.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.677 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.03 -40.04 87.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.769 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.635 ' O ' ' HG3' ' A' ' 47' ' ' GLN . 86.3 tt0 -59.47 -38.98 82.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' C ' ' H ' ' A' ' 47' ' ' GLN . 58.3 mtp180 -59.94 -38.8 83.47 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.88 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.42 28.1 0.17 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 114.539 0.576 . . . . 0.0 114.539 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 94.0 mt-30 -76.18 122.84 24.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 118.01 0.905 . . . . 0.0 110.276 179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.623 ' HE3' ' HA ' ' A' ' 51' ' ' ASP . 55.3 pttt -86.63 114.36 23.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.177 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.4 mm? -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.441 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.9 mt-10 -62.16 -39.99 94.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.064 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.623 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 95.6 m-20 65.77 109.18 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.339 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.8 m -69.29 149.95 47.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.144 0.497 . . . . 0.0 110.794 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.663 ' O ' HG23 ' A' ' 57' ' ' VAL . 91.2 m-85 -63.63 -23.21 67.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.889 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.405 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 32.5 m170 -59.97 -40.0 87.58 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 120.848 0.356 . . . . 0.0 111.004 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD2' ' HE3' ' A' ' 59' ' ' LYS . 6.7 tt -60.82 -42.87 98.57 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 94.9 mt-30 -64.52 -34.75 78.95 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.354 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 53' ' ' TYR . 93.2 t -59.95 -42.57 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.62 ' HZ ' HG23 ' A' ' 129' ' ' THR . 56.9 t80 -59.95 -39.68 86.4 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HE3' ' CD2' ' A' ' 55' ' ' LEU . 94.4 mttt -63.15 -38.86 92.84 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.196 177.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -59.99 -40.08 87.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.056 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.43 -39.99 89.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.07 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 1.013 ' HA ' HD12 ' A' ' 65' ' ' LEU . . . -59.8 -40.03 87.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.999 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -70.12 -43.14 71.62 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.332 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.21 -39.63 90.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.388 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.013 HD12 ' HA ' ' A' ' 62' ' ' ALA . 6.5 mt -63.79 -50.26 69.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.15 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.22 91.79 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.305 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttmm -60.03 -40.03 87.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.753 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.628 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 87.8 t90 -59.95 -43.06 95.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.551 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.937 HG23 HD11 ' A' ' 143' ' ' LEU . 89.4 mt -66.35 -40.02 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-O 121.701 0.762 . . . . 0.0 109.826 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.593 ' HA ' HG12 ' A' ' 73' ' ' VAL . 28.1 ttt -59.98 -35.71 75.59 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.977 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -70.69 -49.46 46.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 109.86 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE2' HD13 ' A' ' 97' ' ' LEU . 48.3 mmtm -62.89 -40.0 96.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.593 HG12 ' HA ' ' A' ' 70' ' ' MET . 10.6 p -70.06 -40.66 78.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.207 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -62.98 -45.48 92.23 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.924 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.0 tt -63.49 -38.45 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.585 HD21 HD12 ' A' ' 146' ' ' LEU . 40.5 tp -61.65 -41.56 97.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.013 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 80' ' ' SER . 76.4 p -73.21 -25.36 60.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.988 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 99.3 m-20 -59.99 -47.78 84.41 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HE2' HD12 ' A' ' 76' ' ' LEU . 55.6 pttt -63.21 -25.23 68.24 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.638 ' HB2' ' O ' ' A' ' 77' ' ' THR . 75.0 m -62.1 -40.02 94.47 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.899 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -58.62 -49.96 75.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -89.93 -79.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.78 0.324 . . . . 0.0 111.465 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.1 p30 -171.62 158.65 4.71 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.73 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -85.69 65.31 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.603 2.202 . . . . 0.0 112.033 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.473 ' O ' ' HD2' ' A' ' 90' ' ' LYS . 40.2 m -81.72 135.11 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.823 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.629 ' OD1' HD13 ' A' ' 154' ' ' LEU . 59.6 t-20 -76.69 127.65 33.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.786 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.65 HG13 ' H ' ' A' ' 90' ' ' LYS . 46.9 pt -154.52 157.58 4.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.036 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -59.96 -37.84 80.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.734 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.15 -45.42 95.43 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.281 -0.962 . . . . 0.0 112.781 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.65 ' H ' HG13 ' A' ' 87' ' ' ILE . 35.6 mttp -61.25 -40.46 94.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.05 0.452 . . . . 0.0 110.138 178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -61.13 -40.62 94.47 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.483 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -61.67 -40.05 93.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.062 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -60.01 -39.82 87.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.609 ' NE2' HG22 ' A' ' 147' ' ' THR . 16.6 t-80 -59.93 -48.8 80.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.631 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 36.4 mt-30 -62.63 -42.22 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.027 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 47.9 t -63.07 -44.36 95.99 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.363 0.601 . . . . 0.0 109.971 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.708 ' O ' HG23 ' A' ' 101' ' ' VAL . 15.4 tp -59.97 -24.59 64.53 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.115 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.63 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -66.71 -45.49 78.59 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.51 0.671 . . . . 0.0 109.739 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.507 ' O ' HG23 ' A' ' 103' ' ' THR . . . -70.01 -39.06 76.07 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.02 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.644 ' HA ' ' OG1' ' A' ' 103' ' ' THR . 76.5 mm-40 -60.92 -40.1 91.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.37 -1.286 . . . . 0.0 112.492 -178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 97' ' ' LEU . 73.7 t -64.55 -49.87 78.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.17 -39.98 92.18 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.907 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.644 ' OG1' ' HA ' ' A' ' 100' ' ' GLU . 20.9 p -69.15 -48.03 63.43 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.341 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.576 ' HE3' ' O ' ' A' ' 65' ' ' LEU . 24.2 tttt -59.95 -40.11 87.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.663 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.658 ' O ' ' HB2' ' A' ' 108' ' ' MET . 32.5 t -58.06 -40.09 80.11 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.654 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 109' ' ' SER . 89.4 mmt-85 -62.9 -40.01 96.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.396 0.617 . . . . 0.0 109.656 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.8 mt -60.03 -28.69 67.95 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' O ' ' A' ' 105' ' ' SER . 94.2 mmm -69.38 -39.35 78.08 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 36.6 t -62.58 -50.06 72.81 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.292 -1.322 . . . . 0.0 108.895 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -62.59 -37.65 87.07 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.263 177.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.531 ' CD1' ' CE1' ' A' ' 58' ' ' PHE . 40.8 tp -59.94 -40.02 87.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.861 -179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -68.67 -42.16 78.25 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -60.11 -36.29 77.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.288 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.445 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 92.0 m -59.55 -38.35 80.84 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.471 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.666 ' HG3' ' HG3' ' A' ' 121' ' ' MET . 33.8 ttm180 -59.84 -44.53 94.04 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -69.22 -31.53 70.17 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.91 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.445 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -57.29 -40.0 76.88 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.175 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.467 ' HB3' ' CE1' ' A' ' 119' ' ' PHE . 79.2 mtp85 -100.97 101.89 12.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.814 0.34 . . . . 0.0 110.748 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 118' ' ' ARG . 1.7 p90 39.46 -90.14 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.743 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 118' ' ' ARG . 14.7 t -161.29 20.88 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.897 0.379 . . . . 0.0 110.732 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 115' ' ' ARG . 99.6 mmm 49.33 178.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.753 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -87.3 156.86 28.62 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.602 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.467 ' HA ' ' ND1' ' A' ' 126' ' ' HIS . 29.2 p-80 -65.93 -40.2 91.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.2 p -75.21 -39.99 59.56 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 0.0 109.485 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.1 -22.57 62.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.74 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.487 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 48.7 m170 -65.23 -43.92 89.92 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -60.72 -45.11 95.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.07 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -62.67 -45.71 91.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.468 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.62 HG23 ' HZ ' ' A' ' 58' ' ' PHE . 91.7 m -64.38 -41.53 96.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 126' ' ' HIS . 91.2 mttt -59.89 -40.07 87.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.674 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.56 -40.04 84.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.928 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.689 ' O ' HD13 ' A' ' 136' ' ' LEU . 15.4 m-70 -60.02 -46.49 89.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.267 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.471 HG13 ' CE ' ' A' ' 108' ' ' MET . 2.5 tt -69.62 -40.38 79.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.849 0.357 . . . . 0.0 111.182 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -64.22 -42.05 96.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.021 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -59.92 -41.66 92.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.096 0.474 . . . . 0.0 111.243 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.01 HD21 ' HB3' ' A' ' 65' ' ' LEU . 8.5 mp -62.93 -40.08 96.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.543 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -61.91 -40.09 94.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.243 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.11 -40.07 90.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.034 0.445 . . . . 0.0 110.734 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.16 -40.02 93.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.335 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.651 ' O ' ' HG ' ' A' ' 144' ' ' LEU . 1.1 m0 -59.93 -42.47 94.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.252 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -60.01 -48.6 81.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.24 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.794 ' O ' HD23 ' A' ' 146' ' ' LEU . 91.8 mt -61.81 -40.58 95.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.97 0.414 . . . . 0.0 110.46 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.937 HD11 HG23 ' A' ' 69' ' ' ILE . 87.9 mt -65.62 -37.78 87.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.716 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 87.3 mt -59.97 -49.03 79.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 98.9 mt-10 -60.0 -40.06 87.93 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 142' ' ' LEU . 3.9 mm? -61.96 -40.25 94.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.766 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.609 HG22 ' NE2' ' A' ' 94' ' ' HIS . 93.8 m -67.63 -42.82 81.7 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.2 mt -60.88 -39.47 89.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.556 -1.202 . . . . 0.0 109.162 177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 43.1 mt-10 -60.01 -47.32 86.31 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.638 -179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 147' ' ' THR . 17.6 ptpt -69.97 -39.6 75.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.339 . . . . 0.0 111.098 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.446 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.97 -40.19 96.61 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.409 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.02 -49.59 77.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.169 0.509 . . . . 0.0 109.728 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.08 -28.53 67.44 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.341 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.629 HD13 ' OD1' ' A' ' 86' ' ' ASN . 0.7 OUTLIER -68.55 -22.25 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.135 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 87.4 mt -65.22 137.65 57.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 83.0 mtt85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.935 179.803 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 ttm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.901 0.382 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.0 -40.05 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.0 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -75.83 130.56 38.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.167 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -85.6 149.4 51.42 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.004 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.38 139.46 59.62 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.57 2.18 . . . . 0.0 112.075 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -78.99 -6.91 57.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.508 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.8 tp10 -93.57 120.01 33.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.748 0.308 . . . . 0.0 110.77 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.0 m -80.01 132.32 35.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 9' ' ' VAL . 11.6 p -89.09 119.97 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.602 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.754 HG11 ' HD2' ' A' ' 16' ' ' LYS . 21.5 t -84.7 119.16 33.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.465 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -81.56 131.16 35.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.1 m -77.82 126.99 31.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.926 0.394 . . . . 0.0 110.897 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -162.58 -26.93 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.34 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.62 -151.3 11.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.332 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.79 133.62 58.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.585 2.19 . . . . 0.0 112.133 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.754 ' HD2' HG11 ' A' ' 10' ' ' VAL . 61.4 pttt -159.98 60.27 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.182 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 m -77.65 130.48 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.64 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.7 mt -77.76 130.37 36.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.296 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' OE2' HD12 ' A' ' 24' ' ' ILE . 82.9 tt0 -122.66 109.24 14.02 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.618 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.4 m -84.66 156.57 21.46 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.579 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.487 ' HA ' HG22 ' A' ' 24' ' ' ILE . . . -63.06 -47.1 84.37 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.08 -41.33 74.23 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.676 -1.147 . . . . 0.0 108.938 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.489 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.02 -47.13 86.15 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.979 178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.618 HG22 ' O ' ' A' ' 20' ' ' THR . 15.4 tt -68.84 -44.84 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.735 178.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.489 ' N ' HG23 ' A' ' 24' ' ' ILE . 57.8 tt0 -60.01 -46.27 90.04 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.488 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.8 mt-10 -61.0 -49.91 75.5 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.492 0.663 . . . . 0.0 109.557 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 31' ' ' VAL . 61.8 ttp180 -62.09 -35.13 77.74 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.986 177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.804 ' O ' HD23 ' A' ' 32' ' ' LEU . 39.6 ttm180 -60.08 -44.42 94.79 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.185 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -62.48 -44.68 95.81 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.007 0.432 . . . . 0.0 111.004 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.05 -42.2 73.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 27' ' ' ARG . 9.5 m -60.02 -41.96 88.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.683 -178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 ' O ' ' A' ' 28' ' ' ARG . 3.5 mm? -60.05 -43.81 95.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 81.6 p -70.29 -40.33 74.35 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 110.878 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' O ' ' HD1' ' A' ' 38' ' ' PHE . 95.6 mtt-85 -66.02 -40.02 90.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.43 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' HE3' ' A' ' 39' ' ' LYS . 64.8 t80 -58.3 -41.54 84.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.554 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.675 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 97.8 mt-30 -67.0 -40.06 87.27 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.539 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.504 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 66.1 p -61.3 -37.93 85.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.138 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.603 ' HD1' ' O ' ' A' ' 34' ' ' ARG . 27.3 m-85 -60.97 -48.88 79.76 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HE3' ' CZ ' ' A' ' 35' ' ' TYR . 97.7 mttt -62.37 -35.0 77.78 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.176 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.8 mt-10 -59.97 -42.46 94.18 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.633 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HD2' ' O ' ' A' ' 37' ' ' SER . 1.7 mpt_? -66.45 -40.18 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 110.911 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' PHE . 99.4 t -63.15 -43.29 98.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.667 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.98 -44.25 94.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.068 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.01 -44.37 94.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.056 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 45' ' ' ARG . 73.2 mtt-85 -60.05 -39.96 87.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.2 105.46 1.3 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.522 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -80.19 121.08 25.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.826 0.346 . . . . 0.0 110.495 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 95.9 mttt -84.81 117.26 23.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.316 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.85 -42.49 70.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.45 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 13.3 pt-20 -178.77 106.21 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 111.148 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 48' ' ' LYS . 97.8 m-20 -80.2 127.0 31.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.044 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.0 t -70.11 129.95 40.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.276 0.56 . . . . 0.0 111.549 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.741 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.8 p90 -65.6 -17.9 64.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.446 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.442 ' HA ' ' CG2' ' A' ' 57' ' ' VAL . 68.8 m-70 -56.2 -36.52 68.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.368 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 3.1 tm? -59.78 -45.06 93.46 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 78.1 mt-30 -68.61 -35.06 76.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.03 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 53' ' ' TYR . 92.1 t -60.88 -41.94 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.762 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 115' ' ' ARG . 63.9 t80 -59.97 -39.98 87.51 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 113.853 -1.521 . . . . 0.0 107.51 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 47.1 mmtm -64.71 -40.0 94.6 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.122 177.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.75 -39.97 95.59 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.566 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 95.9 m-20 -60.01 -40.03 87.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.853 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.63 89.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.94 0.4 . . . . 0.0 111.277 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -70.09 -47.32 62.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.521 0.677 . . . . 0.0 109.202 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -60.59 -36.13 77.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.304 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.0 HD22 ' HE3' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.95 -49.05 79.22 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.903 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.96 -34.58 77.07 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 55.0 tttm -60.3 -42.27 95.18 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.088 0.47 . . . . 0.0 110.935 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.768 ' CZ2' ' HE2' ' A' ' 72' ' ' LYS . 33.2 t90 -60.03 -39.97 87.72 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.294 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.52 HG23 ' CD2' ' A' ' 143' ' ' LEU . 97.3 mt -64.86 -40.86 90.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.725 0.298 . . . . 0.0 110.733 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.654 ' HA ' HG12 ' A' ' 73' ' ' VAL . 76.9 mtm -60.87 -36.06 78.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.851 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -68.76 -49.13 61.23 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.359 0.599 . . . . 0.0 109.875 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.906 ' HD3' HD23 ' A' ' 97' ' ' LEU . 44.2 mmtm -61.75 -40.03 93.68 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.999 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.691 ' HA ' HD12 ' A' ' 76' ' ' LEU . 11.9 p -70.1 -40.0 77.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.209 0.528 . . . . 0.0 112.175 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -63.82 -43.88 94.92 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.717 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.681 HG21 ' CD2' ' A' ' 97' ' ' LEU . 11.6 tt -64.25 -37.25 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 ' HE1' ' A' ' 94' ' ' HIS . 83.2 mt -60.96 -42.45 98.3 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.558 ' O ' ' HB3' ' A' ' 80' ' ' SER . 94.3 m -68.78 -34.25 75.25 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.453 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.535 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.5 t0 -60.06 -42.29 94.2 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.659 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.533 ' HZ3' ' HD2' ' A' ' 150' ' ' LYS . 0.0 OUTLIER -60.03 -25.85 65.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.445 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.6 t -63.91 -44.76 91.96 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.26 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.535 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 70.4 m-85 -59.93 -39.97 87.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.058 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.525 ' HG3' ' HD2' ' A' ' 84' ' ' PRO . 52.1 tp10 -64.05 124.05 20.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.61 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 20.0 m-20 -59.99 -53.83 61.41 Favored Pre-proline 0 N--CA 1.462 0.153 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.393 -178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 77.2 Cg_exo -47.94 156.21 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.479 2.119 . . . . 0.0 112.76 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.6 p -82.66 -178.21 7.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.772 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.664 ' HA ' ' HD2' ' A' ' 90' ' ' LYS . 64.4 t30 -74.38 142.2 45.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.432 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.64 ' N ' HD13 ' A' ' 87' ' ' ILE . 0.2 OUTLIER -154.52 -162.53 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.025 -179.115 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.595 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 78.0 mt-30 -60.07 -39.96 87.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.676 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.65 -52.18 21.85 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.624 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 24.7 mttt -61.81 -40.46 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.083 0.468 . . . . 0.0 110.55 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.09 -41.26 92.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 89.5 mt-30 -60.53 -40.2 90.64 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.267 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.742 ' O ' HD13 ' A' ' 97' ' ' LEU . 62.1 mttp -59.88 -46.13 90.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.644 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.711 ' HE1' HD23 ' A' ' 76' ' ' LEU . 92.6 m-70 -66.98 -40.5 87.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.638 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.5 tt0 -60.0 -42.89 95.23 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.94 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 t -61.49 -43.37 98.99 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.459 0.647 . . . . 0.0 109.991 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.906 HD23 ' HD3' ' A' ' 72' ' ' LYS . 11.2 mp -67.69 -19.31 65.16 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.26 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.638 ' HB2' ' O ' ' A' ' 95' ' ' GLN . 98.9 mt-10 -64.58 -43.65 93.18 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.71 83.45 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.645 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -61.73 -38.98 89.94 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.217 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 97' ' ' LEU . 95.4 t -60.06 -49.97 81.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -64.31 -39.77 94.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.027 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.6 m -60.25 -48.35 82.11 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.132 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 1.0 ' HE3' HD22 ' A' ' 65' ' ' LEU . 52.1 tptt -60.4 -39.87 88.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.483 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.779 ' O ' ' HB2' ' A' ' 108' ' ' MET . 66.8 m -57.72 -38.19 74.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.903 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 109' ' ' SER . 51.9 mtt180 -63.21 -34.37 77.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.568 0.699 . . . . 0.0 109.122 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.622 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.1 tt -59.91 -31.25 69.64 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.779 ' HB2' ' O ' ' A' ' 105' ' ' SER . 95.0 mtp -67.61 -39.16 84.74 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 69.8 m -62.61 -49.58 74.64 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.087 178.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 114' ' ' THR . 98.9 mt-10 -64.44 -37.69 88.4 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.079 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.829 ' O ' HG22 ' A' ' 114' ' ' THR . 36.3 tp -59.97 -41.18 91.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.682 -178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.85 -48.59 53.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.904 0.859 . . . . 0.0 109.429 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.91 -38.18 81.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.854 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.829 HG22 ' O ' ' A' ' 111' ' ' LEU . 1.7 t -60.0 -40.65 89.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.57 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.705 ' HD2' HG21 ' A' ' 129' ' ' THR . 73.2 mtp85 -60.11 -46.37 89.83 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.624 0.726 . . . . 0.0 109.386 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.09 -31.74 72.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.014 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -59.94 -40.04 87.6 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.302 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -106.48 -105.48 0.33 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.114 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -88.53 133.15 34.24 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.725 0.297 . . . . 0.0 110.802 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 t -157.21 27.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.011 0.434 . . . . 0.0 110.948 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 90.8 mmm -81.31 -36.07 30.22 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.767 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.3 110.24 3.02 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.442 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.538 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 50.6 p-80 -67.13 -40.06 86.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.836 0.35 . . . . 0.0 110.872 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 83.5 p -60.89 -40.06 91.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.66 ' O ' ' HG2' ' A' ' 128' ' ' GLU . . . -58.38 -24.06 58.87 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.566 ' O ' ' HG3' ' A' ' 130' ' ' LYS . 76.0 m80 -68.06 -42.37 80.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.068 0.461 . . . . 0.0 110.166 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.05 -43.63 95.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.218 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' ' 125' ' ' ALA . 14.5 pt-20 -61.51 -43.61 98.55 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.84 -0.344 . . . . 0.0 111.031 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.705 HG21 ' HD2' ' A' ' 115' ' ' ARG . 96.6 m -69.38 -40.74 77.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.991 0.424 . . . . 0.0 111.776 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 94.9 mttt -60.04 -39.98 87.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.938 -179.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.76 79.0 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.373 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.93 -43.36 94.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.441 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 111' ' ' LEU . 11.0 tt -67.74 -40.0 83.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.124 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.6 mt-10 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.756 0.312 . . . . 0.0 111.219 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.75 -40.07 91.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.273 0.559 . . . . 0.0 110.461 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.78 HD13 ' HG ' ' A' ' 65' ' ' LEU . 81.0 mt -59.89 -39.86 86.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.839 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -61.58 -39.98 93.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.765 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -62.27 -40.52 96.51 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.979 0.419 . . . . 0.0 110.665 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 143' ' ' LEU . 84.7 mt -66.01 -39.94 90.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.691 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.675 ' NE1' HG13 ' A' ' 101' ' ' VAL . 0.0 OUTLIER -60.1 -40.5 89.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.392 -179.608 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.02 -42.29 94.02 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 64.5 tp -60.06 -49.68 76.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.677 ' HA ' HD12 ' A' ' 146' ' ' LEU . 10.4 mp -63.5 -39.9 95.64 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.929 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.679 ' O ' HD23 ' A' ' 148' ' ' LEU . 9.5 tt -60.5 -48.14 83.06 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.97 -39.1 84.47 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.589 177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.677 HD12 ' HA ' ' A' ' 143' ' ' LEU . 89.1 mt -59.94 -40.54 89.3 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.182 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.8 -46.91 70.61 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.53 0.681 . . . . 0.0 109.259 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.679 HD23 ' O ' ' A' ' 144' ' ' LEU . 4.0 mm? -61.05 -33.81 73.89 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.275 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 146' ' ' LEU . 86.5 tt0 -60.0 -41.87 93.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.068 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.533 ' HD2' ' HZ3' ' A' ' 79' ' ' LYS . 32.2 mmtp -67.5 -43.08 81.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.692 0.758 . . . . 0.0 109.129 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -60.83 -39.06 96.3 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.503 179.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -60.05 -49.83 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 150' ' ' LYS . 14.7 pt20 -70.02 -20.63 63.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.715 178.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.476 ' HB3' ' O ' ' A' ' 151' ' ' GLY . 61.4 tp -68.98 -25.76 64.69 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.008 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.05 133.85 47.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.124 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.845 179.546 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.628 0.251 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 62.82 79.54 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.94 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -71.29 141.47 50.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.789 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.515 ' CZ ' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -85.9 132.67 43.26 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.379 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.558 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 61.4 Cg_endo -73.17 145.82 39.79 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.421 2.08 . . . . 0.0 112.203 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 61.3 mttm 79.22 179.95 0.11 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.939 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -86.08 126.79 34.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.673 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.515 HG21 ' CZ ' ' A' ' 4' ' ' PHE . 73.0 p -80.02 129.73 34.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.169 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 t -94.39 120.0 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 39.6 t -83.57 120.07 34.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.666 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 98.9 mt-10 -157.48 116.24 3.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.919 0.39 . . . . 0.0 111.251 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 t -158.04 100.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.736 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.33 26.39 13.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.893 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.85 109.74 3.37 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.675 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.5 164.66 12.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.555 2.17 . . . . 0.0 112.027 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -74.67 151.67 39.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.388 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.9 129.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.871 0.367 . . . . 0.0 110.576 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -76.34 118.41 19.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.086 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.641 ' HG2' ' CG1' ' A' ' 24' ' ' ILE . 56.6 tt0 -122.46 109.69 14.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.58 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.1 m -88.21 151.87 22.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.74 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 25' ' ' GLN . . . -61.7 -46.78 88.21 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.425 178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HA ' ' HB3' ' A' ' 25' ' ' GLN . 20.5 pt-20 -69.97 -39.07 76.2 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.492 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.24 -47.53 85.58 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.551 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.641 ' CG1' ' HG2' ' A' ' 19' ' ' GLU . 86.7 mt -68.2 -42.9 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.683 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 62.2 tt0 -60.02 -40.37 89.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.918 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -60.31 -49.89 75.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-O 121.46 0.647 . . . . 0.0 109.449 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.412 ' O ' HG23 ' A' ' 31' ' ' VAL . 56.3 ttp180 -65.51 -39.49 91.91 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.572 177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 25' ' ' GLN . 67.3 ttt180 -59.91 -46.43 89.39 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.19 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.06 -41.13 96.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.14 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.69 -44.75 96.15 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.359 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' O ' ' HD2' ' A' ' 35' ' ' TYR . 96.4 t -60.03 -49.94 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.691 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 84.5 mt -61.29 -42.49 98.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.139 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.4 m -61.71 -40.55 95.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.919 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -60.12 -46.67 88.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.266 -179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.453 ' HD2' ' O ' ' A' ' 31' ' ' VAL . 72.0 m-85 -60.09 -45.45 92.87 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.243 0.544 . . . . 0.0 110.417 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 56.8 tt0 -65.99 -38.04 87.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 41' ' ' ARG . 21.5 t -60.4 -40.02 89.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.271 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.92 -48.6 81.06 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 36' ' ' GLN . 7.9 mtmm -62.18 -38.96 91.09 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' ' HA ' ' A' ' 37' ' ' SER . 86.4 tt0 -60.01 -39.92 87.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.583 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 37' ' ' SER . 99.7 mtt180 -59.23 -40.05 84.65 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.784 -179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -60.01 -46.67 93.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.93 94.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 98.3 mt-10 -56.41 -25.85 51.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.329 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -58.57 -40.02 81.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.456 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 106.92 10.76 27.7 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.219 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -77.74 114.46 16.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.456 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -91.05 114.32 26.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.2 tp -90.02 -80.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.076 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -71.68 -54.3 10.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.511 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -156.45 -164.24 1.62 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.88 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.7 m -69.49 130.29 42.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.087 0.47 . . . . 0.0 110.324 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.66 ' O ' HG23 ' A' ' 57' ' ' VAL . 64.7 t80 -59.74 -19.65 51.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.036 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.495 ' ND1' ' HD2' ' A' ' 118' ' ' ARG . 37.2 t-80 -59.41 -40.01 85.25 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.576 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' PHE . 47.2 tp -60.11 -44.52 94.81 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 59.6 mt-30 -61.93 -34.98 77.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.21 -1.359 . . . . 0.0 109.096 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 53' ' ' TYR . 91.8 t -60.16 -42.4 90.05 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 60.0 t80 -60.03 -39.82 87.22 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.555 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 86.2 tttt -64.28 -40.02 95.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.59 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.5 ttt-85 -60.33 -40.02 89.14 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.872 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 65' ' ' LEU . 96.0 m-20 -60.02 -39.64 86.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.7 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.83 -40.02 87.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.871 0.367 . . . . 0.0 110.381 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.3 m-20 -69.19 -44.86 71.32 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.688 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 91.2 m-20 -60.06 -38.14 81.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.971 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.898 HD22 HD23 ' A' ' 136' ' ' LEU . 1.8 tt -60.06 -49.1 79.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.648 -1.16 . . . . 0.0 108.584 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -32.5 83.12 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.291 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 64' ' ' ASP . 60.4 mtpt -59.91 -40.05 87.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.095 0.474 . . . . 0.0 109.79 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.676 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 89.5 t90 -60.01 -43.31 95.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.101 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.733 HG23 HD22 ' A' ' 143' ' ' LEU . 94.7 mt -64.36 -40.02 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.701 ' HA ' HG12 ' A' ' 73' ' ' VAL . 94.7 mtp -61.1 -32.46 72.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.162 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.635 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 98.5 mt-10 -67.67 -49.18 64.09 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.499 0.666 . . . . 0.0 109.587 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.648 ' HD2' HD21 ' A' ' 143' ' ' LEU . 20.8 ttmm -64.95 -38.51 91.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.941 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.701 HG12 ' HA ' ' A' ' 70' ' ' MET . 12.7 p -67.87 -41.34 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.635 ' ND2' ' HA ' ' A' ' 71' ' ' GLU . 12.6 p30 -62.97 -50.03 72.39 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.725 0.774 . . . . 0.0 109.001 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.766 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -60.15 -38.67 77.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.358 -1.292 . . . . 0.0 107.68 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.781 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 44.1 tp -59.99 -40.87 90.62 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 176.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 80' ' ' SER . 86.2 m -66.55 -30.33 70.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.569 176.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.601 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 65.1 t0 -60.0 -40.54 89.55 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.807 -178.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.781 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 19.1 pttm -60.22 -28.13 67.75 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 77' ' ' THR . 24.7 t -60.49 -40.21 90.5 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.901 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.601 ' HD1' ' HA ' ' A' ' 78' ' ' ASP . 93.6 m-85 -59.75 -33.38 71.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.084 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 60.33 43.32 13.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.046 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -70.03 160.01 82.1 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.45 52.17 0.63 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.879 2.386 . . . . 0.0 112.439 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.4 t -85.95 155.73 20.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.867 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -76.73 142.59 40.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.614 HD11 ' HD2' ' A' ' 156' ' ' ARG . 85.5 mt -69.68 -39.91 78.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.997 -178.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.03 -40.04 87.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.81 0.338 . . . . 0.0 110.987 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -71.34 -43.72 53.83 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.968 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.81 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 7.2 ttmm -60.21 -40.55 90.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.026 0.441 . . . . 0.0 110.561 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.456 ' HB2' HD21 ' A' ' 154' ' ' LEU . 69.0 t80 -62.09 -40.04 94.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.254 179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.28 -40.65 94.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.81 ' HG2' ' O ' ' A' ' 90' ' ' LYS . 34.8 pttt -59.98 -39.98 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.231 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' HG3' ' A' ' 150' ' ' LYS . 77.3 m80 -60.08 -44.16 94.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.805 0.336 . . . . 0.0 110.986 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 96.2 mt-30 -64.53 -40.98 96.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.2 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.1 t -61.68 -49.88 74.71 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.23 0.538 . . . . 0.0 110.862 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HG23 ' A' ' 101' ' ' VAL . 9.6 mp -64.62 -19.87 65.94 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.952 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.642 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -63.31 -45.05 93.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.418 0.627 . . . . 0.0 109.585 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.83 -37.1 81.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.683 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.676 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.7 mt-10 -61.85 -38.38 88.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.809 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.798 HG13 ' HE1' ' A' ' 140' ' ' TRP . 96.1 t -59.93 -50.27 80.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.602 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -64.66 -39.94 94.55 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.142 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -63.68 -48.33 77.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.571 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.833 ' HD3' HD12 ' A' ' 107' ' ' LEU . 73.2 mmtt -60.4 -39.97 89.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.827 0.346 . . . . 0.0 111.482 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.627 ' O ' ' HB2' ' A' ' 108' ' ' MET . 84.2 p -59.87 -39.63 85.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.031 0.444 . . . . 0.0 110.219 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 109' ' ' SER . 73.9 ttt180 -66.14 -38.85 89.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.581 0.705 . . . . 0.0 109.115 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' A' ' 104' ' ' LYS . 91.8 mt -60.05 -29.23 68.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 105' ' ' SER . 69.6 mtm -68.15 -36.7 80.07 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 29.7 t -62.81 -50.33 71.4 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.418 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.19 -36.9 84.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.276 177.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 133' ' ' ILE . 1.2 tp -58.23 -40.18 81.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.836 -178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.74 -46.92 77.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.685 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 10.4 mtpm? -60.07 -37.35 79.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.742 177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 94.3 m -60.03 -40.04 87.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.745 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.597 ' HG2' HG21 ' A' ' 129' ' ' THR . 44.7 tpt85 -62.03 -47.38 85.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.584 0.707 . . . . 0.0 109.751 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 113' ' ' LYS . 21.9 pt-20 -69.13 -29.93 68.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.134 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 90.8 mt-10 -56.17 -40.02 73.28 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.029 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.495 ' HD2' ' ND1' ' A' ' 54' ' ' HIS . 8.4 mtt-85 -105.64 140.08 39.25 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 60.09 96.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.88 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.2 t -79.32 168.23 19.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.659 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 68.0 mtt 63.67 100.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.917 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 165.97 70.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.444 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.443 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 45.3 p-80 -63.65 -40.06 95.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 0.0 110.778 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.4 m -61.15 -39.99 92.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.293 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.09 -24.68 59.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.013 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.443 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.28 -40.14 86.1 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.121 0.486 . . . . 0.0 109.86 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.0 -40.03 87.82 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.488 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -64.66 -43.36 93.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.025 0.441 . . . . 0.0 110.525 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.597 HG21 ' HG2' ' A' ' 115' ' ' ARG . 0.8 OUTLIER -71.26 -44.33 65.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.397 179.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -60.02 -42.3 94.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.232 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -62.66 -41.92 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.541 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.556 ' O ' HD13 ' A' ' 136' ' ' LEU . 82.6 t60 -60.08 -47.44 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.549 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 111' ' ' LEU . 88.0 mt -62.17 -39.99 85.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.072 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -47.06 87.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.165 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.25 -42.78 96.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.089 0.471 . . . . 0.0 110.699 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.898 HD23 HD22 ' A' ' 65' ' ' LEU . 9.6 mp -65.96 -37.6 86.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.999 179.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -61.72 -40.02 93.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.556 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.78 -39.98 95.55 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.046 0.45 . . . . 0.0 110.061 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 86.0 mt -65.81 -38.98 90.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.174 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.798 ' HE1' HG13 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -60.04 -40.72 90.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.95 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.453 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.9 m-20 -59.98 -45.55 92.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.691 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 57.8 tp -60.2 -46.7 88.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.645 0.736 . . . . 0.0 109.722 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.733 HD22 HG23 ' A' ' 69' ' ' ILE . 64.4 tp -60.04 -40.03 87.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.649 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.717 HD21 HG11 ' A' ' 101' ' ' VAL . 83.0 mt -60.01 -49.47 77.53 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' ' 149' ' ' GLU . 98.9 mt-10 -59.95 -39.88 87.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.611 176.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 143' ' ' LEU . 87.2 mt -59.59 -39.96 85.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.236 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.914 ' HA ' ' HE2' ' A' ' 150' ' ' LYS . 94.5 m -65.92 -45.87 80.3 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.346 0.593 . . . . 0.0 109.479 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.17 -40.01 88.44 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.463 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 145' ' ' GLU . 75.0 mm-40 -60.28 -46.48 89.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.122 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.914 ' HE2' ' HA ' ' A' ' 147' ' ' THR . 42.0 pttt -70.12 -39.64 75.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.278 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -64.8 -40.18 97.16 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.572 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -65.24 -40.01 93.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.384 0.611 . . . . 0.0 109.43 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -69.71 -24.07 63.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.509 178.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 90' ' ' LYS . 69.0 tp -68.27 -25.97 65.43 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.846 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.09 130.15 39.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.707 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.614 ' HD2' HD11 ' A' ' 87' ' ' ILE . 78.7 mtp180 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.916 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mmm . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.828 0.347 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -79.95 -10.28 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.154 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.22 142.15 39.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.827 0.346 . . . . 0.0 110.868 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -85.98 116.98 67.85 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.434 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.38 133.31 34.38 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.441 2.094 . . . . 0.0 112.142 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -70.2 -40.0 74.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.777 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -103.24 125.59 49.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.966 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 t -80.11 128.85 33.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.604 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.0 m -88.86 117.35 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 CA-C-O 120.928 0.394 . . . . 0.0 111.068 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.8 t -84.2 126.0 40.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.167 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -78.59 129.19 34.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.594 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -160.95 120.73 2.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.276 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.1 p -157.81 9.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -90.06 -89.82 1.28 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.486 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.86 155.12 11.43 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.479 2.12 . . . . 0.0 112.311 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -75.85 143.56 41.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.01 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.7 m -75.37 133.74 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.977 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -75.68 121.58 22.71 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.678 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' A' ' 24' ' ' ILE . 99.2 mt-10 -121.77 110.85 16.42 Favored 'General case' 0 N--CA 1.419 -2.011 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 177.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.658 ' HB ' ' H ' ' A' ' 23' ' ' GLU . 0.7 OUTLIER -80.79 158.1 25.55 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.643 -179.009 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -63.03 -48.09 80.24 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.02 -41.02 71.41 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.231 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.658 ' H ' ' HB ' ' A' ' 20' ' ' THR . 86.6 tt0 -60.83 -48.32 82.34 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.096 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.794 HD11 ' HB3' ' A' ' 19' ' ' GLU . 89.9 mt -69.64 -43.32 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.579 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.59 ' HG3' HH21 ' A' ' 28' ' ' ARG . 64.1 tt0 -59.97 -41.84 92.82 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.47 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.41 -48.39 81.98 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.507 0.67 . . . . 0.0 109.261 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.739 ' O ' HG22 ' A' ' 31' ' ' VAL . 84.4 mtt180 -64.82 -36.25 83.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 108.367 177.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.6 ' HA ' ' CG2' ' A' ' 31' ' ' VAL . 39.0 ttp180 -60.13 -41.53 92.88 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.01 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 67.2 tt0 -61.81 -45.81 92.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.953 0.406 . . . . 0.0 111.017 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -69.37 -44.58 71.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.938 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 27' ' ' ARG . 11.4 m -59.89 -43.83 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.03 -44.63 94.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.749 0.309 . . . . 0.0 111.512 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 80.9 p -70.06 -40.03 75.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.968 0.413 . . . . 0.0 111.26 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.64 ' O ' ' HD2' ' A' ' 38' ' ' PHE . 95.4 mtt-85 -65.72 -40.3 92.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.942 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -59.67 -45.25 92.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.732 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 93.8 mt-30 -61.22 -42.26 98.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.058 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -39.99 92.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.865 0.364 . . . . 0.0 111.777 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.64 ' HD2' ' O ' ' A' ' 34' ' ' ARG . 48.4 m-85 -67.92 -45.61 73.88 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.01 -39.97 87.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.704 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.732 ' HG3' ' O ' ' A' ' 36' ' ' GLN . 98.4 mt-10 -59.78 -43.97 94.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.1 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 mtp-105 -66.05 -40.02 90.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.844 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 38' ' ' PHE . 48.3 t -67.32 -42.25 87.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.71 -47.99 83.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -59.95 -45.06 93.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.478 ' O ' ' HG2' ' A' ' 121' ' ' MET . 59.9 ttt85 -60.3 -39.78 88.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.378 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 72.01 141.75 0.35 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.1 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -79.15 112.76 16.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.769 0.319 . . . . 0.0 110.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 58.5 tttp -89.4 136.95 32.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.214 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 84.7 mt -161.5 -64.67 0.06 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.701 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 51' ' ' ASP . 98.8 mt-10 -65.63 -39.89 91.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.213 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.413 ' OD1' ' HE3' ' A' ' 48' ' ' LYS . 66.1 m-20 69.42 102.29 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.078 0.466 . . . . 0.0 110.202 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.9 p -69.81 148.35 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.58 -178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.799 ' O ' HG23 ' A' ' 57' ' ' VAL . 86.0 m-85 -69.91 -19.06 63.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.563 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.778 ' HB3' HH11 ' A' ' 118' ' ' ARG . 72.3 m80 -55.46 -38.63 69.3 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.631 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG3' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -60.44 -43.09 97.16 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.025 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.498 ' HA ' ' HD2' ' A' ' 59' ' ' LYS . 96.7 mt-30 -68.04 -35.36 78.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.714 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 53' ' ' TYR . 62.0 t -61.45 -47.09 95.01 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.562 ' HB2' ' NE ' ' A' ' 118' ' ' ARG . 63.3 t80 -59.94 -39.97 87.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 176.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HG3' ' O ' ' A' ' 55' ' ' LEU . 23.7 mttm -62.62 -39.9 95.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.652 -1.158 . . . . 0.0 109.36 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.415 ' N ' ' O ' ' A' ' 56' ' ' GLN . 23.8 ttt180 -60.99 -41.63 96.88 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.219 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -59.95 -38.75 83.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.358 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.889 ' HB1' ' CD2' ' A' ' 132' ' ' HIS . . . -60.01 -40.03 87.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.118 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -67.01 -44.44 80.3 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.452 ' O ' ' HB3' ' A' ' 67' ' ' LYS . 86.7 m-20 -61.46 -38.29 86.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.644 176.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.644 HD12 HD13 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -60.12 -49.05 79.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.919 179.398 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.48 -33.27 86.79 Favored Glycine 0 N--CA 1.44 -1.058 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 64' ' ' ASP . 62.6 tttp -59.92 -41.3 91.43 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.359 -0.421 . . . . 0.0 110.357 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.862 ' CD1' ' HE3' ' A' ' 104' ' ' LYS . 49.9 t90 -60.04 -40.53 89.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.576 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.94 HG23 HD11 ' A' ' 143' ' ' LEU . 97.1 mt -63.4 -41.33 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.127 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.459 ' O ' ' HB ' ' A' ' 73' ' ' VAL . 95.8 mtp -59.99 -38.24 82.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.771 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -61.32 -44.4 97.26 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.902 ' HD2' HD11 ' A' ' 97' ' ' LEU . 71.1 mmtt -61.23 -34.04 74.47 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.593 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.85 HG23 ' O ' ' A' ' 69' ' ' ILE . 38.4 t -66.65 -40.97 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.567 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -64.84 -45.96 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.953 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 1.123 HD11 ' HD2' ' A' ' 93' ' ' LYS . 19.8 tt -65.2 -37.11 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.853 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 43.0 tp -59.94 -41.41 91.77 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.275 178.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.757 ' O ' ' HB2' ' A' ' 80' ' ' SER . 88.8 m -69.04 -31.44 70.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.601 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 65.0 t0 -59.96 -42.79 94.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.366 -178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.853 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 18.3 pttp -60.82 -25.64 66.74 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 77' ' ' THR . 73.3 m -60.71 -40.05 90.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.827 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.601 ' HD2' ' HA ' ' A' ' 78' ' ' ASP . 91.0 m-85 -58.74 -41.63 86.91 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.433 -178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.963 ' HG3' ' HD3' ' A' ' 84' ' ' PRO . 51.2 tp10 -140.08 128.59 22.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.957 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.57 68.17 81.18 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.851 0.358 . . . . 0.0 111.501 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.963 ' HD3' ' HG3' ' A' ' 82' ' ' GLU . 86.7 Cg_endo -85.17 179.4 4.13 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.943 2.429 . . . . 0.0 111.72 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 12.3 m -79.91 -70.41 0.52 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.471 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.63 ' C ' HG13 ' A' ' 87' ' ' ILE . 98.1 m-20 -78.12 128.47 33.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.578 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.847 HD13 ' HD2' ' A' ' 90' ' ' LYS . 18.8 mt -154.81 87.3 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.881 0.372 . . . . 0.0 111.32 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.465 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 97.2 mt-30 -61.15 -40.03 92.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.907 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.65 -49.56 42.66 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.252 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.847 ' HD2' HD13 ' A' ' 87' ' ' ILE . 34.0 mttm -62.09 -40.12 94.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.092 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -60.61 -41.5 94.91 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.587 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 93.6 mt-30 -61.24 -49.16 78.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.921 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 1.123 ' HD2' HD11 ' A' ' 75' ' ' ILE . 37.8 pttt -59.95 -37.0 78.3 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.681 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.741 ' CE1' HG22 ' A' ' 147' ' ' THR . 0.8 OUTLIER -59.71 -49.23 78.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.183 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.705 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 98.1 mt-30 -61.15 -46.44 90.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.005 0.431 . . . . 0.0 111.22 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.5 m -61.83 -40.51 95.55 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.413 0.625 . . . . 0.0 109.825 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.902 HD11 ' HD2' ' A' ' 72' ' ' LYS . 8.8 tt -65.23 -22.39 66.87 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.57 177.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 94' ' ' HIS . 99.1 mt-10 -66.47 -44.13 83.55 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.442 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.58 75.27 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.224 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.87 -40.41 95.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.317 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 97' ' ' LEU . 71.6 t -61.91 -50.26 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 CA-C-O 121.524 0.678 . . . . 0.0 109.197 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.28 -38.37 89.09 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.444 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.889 ' O ' ' HG2' ' A' ' 106' ' ' ARG . 94.2 m -68.1 -47.31 68.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.202 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.862 ' HE3' ' CD1' ' A' ' 68' ' ' TRP . 70.4 mmtt -63.64 -38.97 93.13 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.074 0.464 . . . . 0.0 110.156 179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 108' ' ' MET . 45.9 t -59.73 -39.92 86.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.122 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.889 ' HG2' ' O ' ' A' ' 103' ' ' THR . 44.5 ptt85 -67.01 -34.86 78.64 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.47 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 10.2 tt -59.88 -31.13 69.5 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 176.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.709 ' HB3' ' O ' ' A' ' 105' ' ' SER . 65.5 ttp -67.09 -37.98 84.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 60.1 m -64.19 -50.52 67.78 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.073 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -61.7 -38.09 86.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.706 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.683 HD23 HD12 ' A' ' 133' ' ' ILE . 61.8 tp -59.04 -40.31 84.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.802 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -65.93 -44.64 84.51 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -60.03 -36.89 78.25 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.707 177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.461 ' HB ' ' O ' ' A' ' 111' ' ' LEU . 93.7 m -59.9 -39.48 85.52 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.46 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.526 ' O ' ' HB ' ' A' ' 120' ' ' THR . 39.3 ttm180 -59.92 -47.64 84.95 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.74 -35.0 77.95 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.99 -40.79 90.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.763 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.778 HH11 ' HB3' ' A' ' 54' ' ' HIS . 85.1 mtt-85 -81.28 -169.28 2.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.575 ' O ' HG22 ' A' ' 120' ' ' THR . 87.2 m-85 -70.1 -38.8 75.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.559 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 119' ' ' PHE . 7.6 t 48.59 34.67 5.17 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.832 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 73.8 mtm -84.21 133.14 34.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.714 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 118.52 106.55 2.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.872 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.542 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 52.7 p-80 -64.63 -40.04 94.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.565 0.221 . . . . 0.0 111.289 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.4 p -69.6 -39.97 76.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.903 0.383 . . . . 0.0 110.268 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.81 ' O ' HG22 ' A' ' 129' ' ' THR . . . -59.87 -23.08 63.14 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.542 ' HB3' ' O ' ' A' ' 123' ' ' HIS . 56.3 t-80 -66.15 -45.1 82.18 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.043 179.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.36 -43.38 97.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.307 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -62.35 -46.71 87.44 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.518 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.81 HG22 ' O ' ' A' ' 125' ' ' ALA . 2.0 t -69.56 -44.59 70.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.431 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 87.6 tttt -59.85 -41.36 91.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.155 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 135' ' ' GLU . . . -67.59 -40.19 84.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.494 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.889 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 84.2 t60 -60.03 -45.1 93.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.317 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.683 HD12 HD23 ' A' ' 111' ' ' LEU . 16.1 tt -69.0 -39.99 80.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.951 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 130' ' ' LYS . 98.8 mt-10 -60.8 -40.12 91.44 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.904 0.383 . . . . 0.0 110.993 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 139' ' ' LEU . 77.9 mm-40 -61.11 -39.91 91.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.767 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.644 HD13 HD12 ' A' ' 65' ' ' LEU . 92.1 mt -59.97 -39.62 86.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -61.6 -39.94 93.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.703 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -60.83 -42.5 97.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.787 0.327 . . . . 0.0 110.821 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.4 mm? -68.14 -39.04 82.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.365 0.603 . . . . 0.0 109.843 178.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.53 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -59.97 -41.14 91.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.606 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.47 ' HA ' HD12 ' A' ' 144' ' ' LEU . 95.5 m-20 -60.05 -44.65 94.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.73 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.5 mt -61.14 -41.91 97.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.449 . . . . 0.0 110.307 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.94 HD11 HG23 ' A' ' 69' ' ' ILE . 97.5 mt -62.94 -38.51 91.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.75 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.685 HD21 HG11 ' A' ' 101' ' ' VAL . 84.3 mt -60.18 -50.03 75.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.54 -40.11 90.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.494 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.744 HD13 ' CD2' ' A' ' 76' ' ' LEU . 94.2 mt -61.51 -42.71 99.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.347 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.751 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 85.0 m -67.97 -46.74 70.52 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.866 0.841 . . . . 0.0 109.342 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.42 -38.76 85.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.187 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -60.01 -43.55 95.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.477 -1.238 . . . . 0.0 111.528 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.751 ' HG2' ' O ' ' A' ' 147' ' ' THR . 62.3 pttt -68.8 -39.36 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.481 ' HA2' ' HB2' ' A' ' 154' ' ' LEU . . . -59.76 -34.04 80.56 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.482 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -60.24 -43.91 95.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 29.2 mm100 -70.05 -25.35 63.51 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.148 178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 150' ' ' LYS . 3.4 mm? -68.68 -24.94 64.57 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.947 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.25 137.41 56.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.776 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.947 -179.97 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.916 0.389 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 59.29 -175.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.993 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -75.58 149.94 38.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.997 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -85.07 151.15 56.74 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.825 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.36 137.35 73.93 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.485 2.123 . . . . 0.0 112.159 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -161.56 160.06 28.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.13 142.55 57.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.737 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -76.96 134.86 38.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.275 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.6 m -84.92 135.36 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.562 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 16.1 m -77.25 139.65 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.289 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 10' ' ' VAL . 47.4 mt-10 71.32 141.32 0.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.005 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 4.1 m 68.34 20.36 8.69 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.305 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.3 t -79.97 -8.45 59.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.248 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.577 ' N ' ' HD2' ' A' ' 15' ' ' PRO . . . 159.93 -51.12 0.37 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.573 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.577 ' HD2' ' N ' ' A' ' 14' ' ' GLY . 21.4 Cg_endo -60.8 156.13 45.03 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.363 2.042 . . . . 0.0 112.189 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -78.02 123.44 26.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.804 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.7 t -82.15 113.89 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.428 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -80.02 125.65 30.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.686 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -122.41 109.44 14.4 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.777 0.798 . . . . 0.0 108.932 177.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.7 ' O ' HG22 ' A' ' 24' ' ' ILE . 2.9 m -91.95 152.47 20.01 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.801 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 25' ' ' GLN . . . -63.27 -47.91 80.4 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.529 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 14.2 pt-20 -71.45 -41.72 69.09 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.421 -0.809 . . . . 0.0 108.99 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.657 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.4 tt0 -60.46 -47.86 84.28 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.643 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.7 HG22 ' O ' ' A' ' 20' ' ' THR . 9.5 tp -69.26 -41.38 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.612 178.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 92.7 mt-30 -63.37 -40.06 96.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.905 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 98.6 mt-10 -66.42 -49.91 65.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.746 0.784 . . . . 0.0 110.181 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.648 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.8 mtm180 -66.75 -39.99 88.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.546 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 50.7 ptt85 -60.15 -39.53 86.71 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.883 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 25' ' ' GLN . 77.6 mt-30 -59.98 -41.3 91.69 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.117 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -70.02 -42.41 72.99 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.574 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 27' ' ' ARG . 92.1 t -60.01 -42.5 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.629 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.98 -49.45 77.61 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.199 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.3 m -62.16 -41.87 98.72 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.196 0.522 . . . . 0.0 110.133 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.477 ' CG ' ' HE2' ' A' ' 38' ' ' PHE . 60.2 ttp180 -62.39 -41.37 98.6 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.241 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -59.99 -41.53 92.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.292 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.9 -40.0 93.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.86 0.362 . . . . 0.0 110.709 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.2 m -62.43 -39.98 95.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.312 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.477 ' HE2' ' CG ' ' A' ' 34' ' ' ARG . 40.0 m-85 -65.79 -48.55 71.38 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -60.42 -39.97 89.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.606 177.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.01 -44.54 94.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.871 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.601 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 32.6 ttt85 -63.19 -40.05 96.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.872 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 38' ' ' PHE . 66.1 t -69.23 -43.93 81.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.906 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.94 -46.91 87.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.617 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.627 ' HA ' ' CE ' ' A' ' 48' ' ' LYS . 14.1 pt-20 -60.08 -40.36 89.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.558 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 41' ' ' ARG . 29.4 mmt85 -60.06 -39.98 87.9 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.029 0.442 . . . . 0.0 110.814 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -98.09 -170.11 32.2 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.949 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 5.4 pm0 -76.31 119.04 19.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.142 0.496 . . . . 0.0 110.406 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.627 ' CE ' ' HA ' ' A' ' 44' ' ' GLU . 55.7 mttt -81.78 144.27 31.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.909 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.1 mp -70.11 -35.13 73.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.407 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -62.34 -37.16 84.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.882 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' CG ' HD13 ' A' ' 55' ' ' LEU . 95.9 m-20 -79.56 143.1 35.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.855 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.2 t -69.57 163.98 24.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.035 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.746 ' O ' HG23 ' A' ' 57' ' ' VAL . 96.0 m-85 -60.03 -32.37 70.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.456 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.48 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 77.2 m80 -59.44 -39.59 84.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.7 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.509 HD13 ' CG ' ' A' ' 51' ' ' ASP . 7.8 tt -60.0 -44.15 94.72 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.521 ' O ' ' HB3' ' A' ' 59' ' ' LYS . 64.1 tt0 -63.57 -35.84 81.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.373 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 53' ' ' TYR . 97.7 t -61.21 -43.21 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.575 ' HE1' ' O ' ' A' ' 111' ' ' LEU . 60.6 t80 -60.07 -39.99 87.98 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.126 -1.397 . . . . 0.0 107.303 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 56' ' ' GLN . 54.8 tttm -63.34 -39.94 95.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.761 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.29 -39.94 92.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.378 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -59.98 -39.03 84.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.952 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.628 ' HB1' ' NE2' ' A' ' 132' ' ' HIS . . . -59.84 -40.06 87.25 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.943 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.659 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.0 m-20 -67.21 -44.83 78.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.655 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 93.6 m-20 -59.95 -38.96 83.98 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.89 -1.05 . . . . 0.0 108.883 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.848 HD23 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -60.08 -49.66 76.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.684 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.72 84.26 Favored Glycine 0 N--CA 1.442 -0.92 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 94.3 mttt -60.01 -39.91 87.42 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 120.995 0.426 . . . . 0.0 109.927 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.783 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 79.6 t90 -60.1 -41.41 92.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.825 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.7 mt -63.24 -39.96 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.747 ' HA ' HG12 ' A' ' 73' ' ' VAL . 97.0 mtp -60.15 -33.51 72.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.608 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.71 -49.7 61.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.742 0.782 . . . . 0.0 109.381 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.631 ' HD2' ' O ' ' A' ' 68' ' ' TRP . 0.5 OUTLIER -63.14 -39.99 96.28 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.231 -1.35 . . . . 0.0 110.828 178.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.747 HG12 ' HA ' ' A' ' 70' ' ' MET . 15.0 p -69.25 -40.33 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.526 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -65.53 -47.18 76.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.76 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.668 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 15.3 tt -61.59 -39.97 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 176.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.445 ' CD2' HD13 ' A' ' 146' ' ' LEU . 62.0 tp -61.28 -41.43 96.95 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.039 178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.641 ' O ' ' HB3' ' A' ' 80' ' ' SER . 90.6 m -67.09 -29.36 69.1 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.257 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 97.6 m-20 -59.98 -40.32 88.7 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.552 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.668 ' HE2' ' O ' ' A' ' 75' ' ' ILE . 21.5 mmtt -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 77' ' ' THR . 23.2 t -62.95 -40.11 96.65 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.062 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.706 ' CD2' ' HG3' ' A' ' 82' ' ' GLU . 68.1 t80 -58.84 -49.82 76.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.091 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.706 ' HG3' ' CD2' ' A' ' 81' ' ' TYR . 96.5 mt-10 -126.03 -87.4 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.844 0.354 . . . . 0.0 110.779 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -151.41 150.66 27.38 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.257 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.61 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 27.2 Cg_exo -61.13 -175.56 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.035 1.823 . . . . 0.0 111.682 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.729 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 1.4 p -81.75 138.26 35.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.269 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -78.43 129.19 34.64 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.726 HG13 ' H ' ' A' ' 88' ' ' GLN . 8.8 pt 36.5 -86.73 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.726 ' H ' HG13 ' A' ' 87' ' ' ILE . 77.8 mt-30 -59.96 -39.98 87.46 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -177.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -69.76 -47.46 48.15 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 119.973 -1.108 . . . . 0.0 112.505 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.879 ' HD2' HD22 ' A' ' 154' ' ' LEU . 12.1 tmtt? -60.13 -42.73 95.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.831 0.315 . . . . 0.0 110.956 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.426 ' CZ ' HD21 ' A' ' 154' ' ' LEU . 23.7 m-85 -60.05 -39.93 87.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.809 0.338 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.0 tt0 -62.6 -47.04 85.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.827 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.707 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 ttpm? -59.94 -48.66 80.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.592 ' CD2' HG22 ' A' ' 147' ' ' THR . 14.4 t-80 -66.52 -49.31 66.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 0.0 111.404 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.5 mt-30 -64.16 -50.03 69.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.555 -178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.1 m -60.5 -44.18 96.25 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.238 0.542 . . . . 0.0 110.807 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 101' ' ' VAL . 10.9 mp -69.2 -19.59 63.98 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.052 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.657 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.4 tt0 -64.54 -44.84 89.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.545 0.688 . . . . 0.0 109.452 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.56 76.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.113 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.783 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 98.8 mt-10 -62.47 -40.05 95.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.188 -179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 97' ' ' LEU . 87.9 t -60.54 -49.85 82.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -61.58 -38.88 89.17 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.208 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.5 m -63.23 -48.91 76.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.525 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.766 ' HE2' ' CD1' ' A' ' 68' ' ' TRP . 13.9 mmtt -63.42 -40.02 96.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.094 0.473 . . . . 0.0 110.806 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.739 ' O ' ' HB2' ' A' ' 108' ' ' MET . 79.4 p -59.08 -39.77 83.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.416 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 109' ' ' SER . 63.5 mtt180 -66.09 -40.05 90.5 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.513 0.673 . . . . 0.0 109.405 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.62 HD12 ' HD3' ' A' ' 104' ' ' LYS . 95.5 mt -59.94 -30.64 69.21 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.739 ' HB2' ' O ' ' A' ' 105' ' ' SER . 97.3 mtp -68.27 -37.74 81.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 106' ' ' ARG . 49.0 m -65.08 -49.95 68.03 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.525 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -65.37 -36.77 85.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.431 -1.259 . . . . 0.0 109.853 178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.575 ' O ' ' HE1' ' A' ' 58' ' ' PHE . 38.3 tp -58.27 -42.09 85.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.591 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.9 -42.53 76.76 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.881 0.848 . . . . 0.0 108.815 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.03 -36.25 76.85 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.526 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 94.9 m -60.16 -42.93 95.98 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.731 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.503 ' HG3' ' CD2' ' A' ' 119' ' ' PHE . 0.0 OUTLIER -60.14 -47.41 86.02 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.34 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.46 -31.11 72.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.988 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.5 tt0 -56.71 -40.08 75.02 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.56 -178.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.5 mtt-85 -106.18 -30.92 8.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.537 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . 0.503 ' CD2' ' HG3' ' A' ' 115' ' ' ARG . 78.0 m-85 -92.08 139.97 30.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.971 0.415 . . . . 0.0 111.094 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 15.2 t -157.0 28.26 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.728 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 27.0 ttt -152.11 -36.28 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.04 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -78.78 93.35 1.27 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.577 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 75.5 m80 -68.27 -39.96 82.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 0.0 110.883 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 82.9 p -60.76 -39.89 90.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.046 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.29 -25.31 47.97 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 75.5 m80 -67.45 -41.97 83.86 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.89 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.59 -41.97 95.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.017 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -62.68 -41.08 98.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.67 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.3 m -66.4 -43.01 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.913 0.387 . . . . 0.0 110.836 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.97 -41.04 91.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.51 -43.6 89.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.19 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.658 ' NE2' HD11 ' A' ' 136' ' ' LEU . 84.1 t60 -60.03 -46.18 90.34 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.462 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.488 HG23 ' HE2' ' A' ' 108' ' ' MET . 78.4 mt -67.77 -38.91 81.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.08 -48.04 83.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.807 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -62.41 -42.28 99.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.266 0.555 . . . . 0.0 109.908 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.848 HD13 HD23 ' A' ' 65' ' ' LEU . 83.0 mt -62.44 -39.97 95.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.297 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -61.38 -40.05 92.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.634 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -60.3 -42.99 96.67 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.212 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.67 -40.02 95.77 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.506 0.67 . . . . 0.0 109.318 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.504 ' HZ2' ' HB2' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -60.0 -39.99 87.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.092 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -60.04 -40.49 89.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.345 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 85.6 mt -60.09 -45.63 92.3 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 146' ' ' LEU . 61.1 tp -60.06 -39.99 87.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.122 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.552 HD21 HG11 ' A' ' 101' ' ' VAL . 88.1 mt -62.97 -47.83 81.49 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.93 -40.04 87.54 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.125 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.5 mt -61.56 -40.63 95.41 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.77 ' O ' ' HG2' ' A' ' 150' ' ' LYS . 94.1 m -67.8 -46.44 71.9 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.794 0.807 . . . . 0.0 109.127 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.59 -39.39 87.91 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.076 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -60.09 -45.75 91.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.395 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.77 ' HG2' ' O ' ' A' ' 147' ' ' THR . 15.1 pttt -66.03 -39.6 90.34 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.736 0.303 . . . . 0.0 110.809 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.517 ' O ' ' HB3' ' A' ' 154' ' ' LEU . . . -61.58 -40.12 98.29 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.87 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.8 -43.42 98.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -69.96 -21.16 63.28 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.764 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.879 HD22 ' HD2' ' A' ' 90' ' ' LYS . 56.6 tp -68.31 -26.04 65.43 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.164 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.4 137.39 52.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.594 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.86 -179.762 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.612 0.244 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -79.99 -9.96 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.229 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -74.53 137.57 42.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.839 0.352 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -85.47 140.24 36.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.09 135.49 47.61 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.161 . . . . 0.0 112.141 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -80.01 -9.92 59.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.372 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -94.83 135.17 36.65 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.872 0.368 . . . . 0.0 110.606 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 70.6 p -79.53 132.97 36.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 9' ' ' VAL . 11.9 p -91.35 119.92 39.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.143 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.6 t -80.83 127.19 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.92 0.391 . . . . 0.0 110.729 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.773 ' HB3' ' HD3' ' A' ' 15' ' ' PRO . 84.3 tt0 -79.12 132.1 36.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.686 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.6 t -78.72 130.0 35.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.068 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.94 35.41 21.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.625 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -131.88 -82.26 0.23 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.224 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.773 ' HD3' ' HB3' ' A' ' 11' ' ' GLU . 98.4 Cg_endo -80.16 138.76 12.93 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.434 2.756 . . . . 0.0 112.98 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm 60.14 39.94 18.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.258 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 14' ' ' GLY . 39.5 t -80.16 116.91 25.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' C ' ' A' ' 18' ' ' LEU . 10.2 tt -80.07 106.09 11.83 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 1.07 ' HB2' HD11 ' A' ' 24' ' ' ILE . 14.4 pt-20 -123.89 109.66 13.88 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.718 ' HB ' ' CB ' ' A' ' 23' ' ' GLU . 2.0 m -87.25 149.72 24.39 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.067 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.8 -47.8 76.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 98.9 mt-10 -70.89 -41.99 70.6 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.306 178.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.718 ' CB ' ' HB ' ' A' ' 20' ' ' THR . 86.5 tt0 -60.16 -48.02 83.5 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.254 0.549 . . . . 0.0 109.808 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.07 HD11 ' HB2' ' A' ' 19' ' ' GLU . 89.8 mt -69.09 -42.9 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.484 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' ALA . 64.1 tt0 -60.05 -40.86 90.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.678 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 98.6 mt-10 -61.13 -44.43 97.34 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.607 0.718 . . . . 0.0 109.727 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.831 ' O ' HG23 ' A' ' 31' ' ' VAL . 21.8 mmm180 -69.33 -36.16 76.66 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -60.01 -46.61 88.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.503 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 15.9 pt20 -63.11 -40.61 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 110.966 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.55 -42.78 99.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.358 0.599 . . . . 0.0 110.671 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 27' ' ' ARG . 78.0 t -60.07 -47.29 92.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.996 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.95 -40.76 90.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.907 0.384 . . . . 0.0 111.23 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.5 m -63.61 -39.96 95.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.811 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 69.8 mtt180 -62.39 -40.54 96.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.554 ' HE2' HG12 ' A' ' 31' ' ' VAL . 41.8 m-85 -59.96 -40.66 89.81 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.883 0.373 . . . . 0.0 110.907 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -67.23 -40.0 86.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.6 t -62.95 -39.95 96.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.169 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 52.0 m-85 -65.73 -47.56 74.89 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -61.67 -38.12 86.59 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.599 177.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.98 -42.65 94.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.18 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -62.1 -40.45 95.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 66.4 t -65.68 -40.35 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.25 -43.91 95.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.514 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -60.03 -48.19 82.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.735 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -59.91 -40.13 87.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.802 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.61 -178.32 45.25 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.851 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -76.39 115.93 16.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.007 0.432 . . . . 0.0 110.781 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' O ' ' HG ' ' A' ' 49' ' ' LEU . 41.9 mtmt -81.84 154.61 25.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.175 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 84.6 mt -155.4 -43.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 98.9 mt-10 79.5 106.39 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.442 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -80.02 148.3 31.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.198 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.8 p -69.79 153.21 43.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 111.004 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.874 ' O ' HG23 ' A' ' 57' ' ' VAL . 94.0 m-85 -66.85 -22.7 65.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.452 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.459 ' HB2' ' NH2' ' A' ' 118' ' ' ARG . 75.9 m80 -60.05 -40.02 87.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.559 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.06 -45.26 93.45 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 59' ' ' LYS . 97.6 mt-30 -64.12 -35.59 81.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.893 177.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 53' ' ' TYR . 90.1 t -61.35 -43.83 97.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.617 ' HZ ' HG23 ' A' ' 129' ' ' THR . 54.3 t80 -60.02 -39.64 86.56 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 56' ' ' GLN . 68.5 mttm -64.4 -39.96 94.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.74 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 52.7 mmm-85 -63.07 -42.07 99.58 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.854 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -62.81 -39.93 95.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.182 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -39.94 87.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.64 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.732 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 95.9 m-20 -69.23 -53.3 20.6 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.867 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 89.4 m-20 -60.01 -39.03 84.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.307 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.514 ' CD1' ' HE2' ' A' ' 104' ' ' LYS . 40.2 tp -60.1 -50.03 75.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.397 179.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.17 -33.25 86.73 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.732 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 97.0 mttt -59.99 -40.0 87.65 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.192 -0.504 . . . . 0.0 109.896 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.54 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 60.1 t90 -59.25 -42.23 90.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.255 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.789 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.7 mt -63.01 -42.11 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.78 ' O ' HG22 ' A' ' 73' ' ' VAL . 98.7 mmm -60.56 -33.57 72.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.3 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -63.95 -47.41 80.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.825 ' HG3' HD22 ' A' ' 97' ' ' LEU . 37.9 ttmt -60.43 -39.96 89.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.079 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 76' ' ' LEU . 2.0 m -69.91 -39.93 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.306 0.574 . . . . 0.0 111.019 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -62.65 -44.83 95.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.589 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 72' ' ' LYS . 15.2 tt -62.99 -36.91 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.987 HD13 HD23 ' A' ' 146' ' ' LEU . 74.3 mt -62.0 -41.45 98.06 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.093 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.62 ' O ' ' HB2' ' A' ' 80' ' ' SER . 94.0 m -69.05 -34.94 76.0 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.52 177.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ILE . 95.5 m-20 -59.99 -41.03 91.18 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.491 -178.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.818 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 47.8 pttt -60.96 -26.34 67.48 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.62 ' HB2' ' O ' ' A' ' 77' ' ' THR . 49.8 m -63.9 -46.22 85.82 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.481 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.0 -48.54 81.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.123 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -134.14 143.32 47.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.595 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.0 129.39 92.26 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.223 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.28 -166.14 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.458 2.106 . . . . 0.0 112.229 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.766 ' HB ' ' HA3' ' A' ' 89' ' ' GLY . 36.9 m -81.31 138.3 35.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.163 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 87' ' ' ILE . 80.8 m-20 -76.58 121.23 22.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.197 0.522 . . . . 0.0 111.298 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.639 ' N ' HD11 ' A' ' 154' ' ' LEU . 78.6 mt 70.79 -62.8 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.855 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.953 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 94.0 mt-30 -60.11 -41.65 93.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.053 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.766 ' HA3' ' HB ' ' A' ' 85' ' ' THR . . . -76.21 -40.69 28.43 Favored Glycine 0 CA--C 1.504 -0.605 0 C-N-CA 120.511 -0.852 . . . . 0.0 113.168 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.864 ' HD2' ' HA2' ' A' ' 151' ' ' GLY . 14.1 ttpt -59.95 -50.13 74.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.943 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.953 ' CE2' ' HA ' ' A' ' 88' ' ' GLN . 1.4 p90 -63.73 -34.43 77.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.187 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.471 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 57.2 tt0 -60.56 -52.02 66.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.251 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.665 ' HB2' ' NZ ' ' A' ' 150' ' ' LYS . 14.1 mptt -60.65 -45.78 92.79 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.682 0.277 . . . . 0.0 111.45 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.759 ' NE2' ' HE2' ' A' ' 150' ' ' LYS . 45.4 m170 -61.58 -43.17 99.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.771 0.319 . . . . 0.0 111.701 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 64.1 tt0 -60.97 -46.07 92.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.312 -179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 82.6 p -62.5 -43.82 97.89 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.363 0.601 . . . . 0.0 110.243 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.841 ' O ' HG23 ' A' ' 101' ' ' VAL . 17.0 mt -63.74 -24.44 67.77 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.506 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.699 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 86.5 tt0 -65.88 -44.82 84.23 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.613 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.38 -36.95 77.29 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.916 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.54 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 43.7 mt-10 -61.83 -40.21 94.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.604 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 97' ' ' LEU . 97.1 t -62.08 -50.04 81.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.77 0.795 . . . . 0.0 108.961 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.13 -39.29 89.49 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.159 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.0 m -66.55 -48.65 69.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.463 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.709 ' HB3' ' HZ2' ' A' ' 140' ' ' TRP . 10.7 tmtt? -60.69 -39.46 88.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.319 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.664 ' HB2' ' HH2' ' A' ' 140' ' ' TRP . 26.6 t -58.12 -39.97 80.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.849 0.357 . . . . 0.0 111.167 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -64.0 -40.02 95.44 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.25 0.548 . . . . 0.0 109.989 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 111' ' ' LEU . 94.9 mt -60.52 -31.99 71.04 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.663 ' HB3' ' O ' ' A' ' 105' ' ' SER . 57.5 ttm -69.36 -38.24 77.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.41 -1.268 . . . . 0.0 107.912 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 p -63.21 -50.87 68.56 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.463 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.29 -39.66 89.52 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.135 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.446 HD22 HD22 ' A' ' 65' ' ' LEU . 44.9 tp -60.04 -40.37 89.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.851 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -68.82 -45.18 71.88 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.679 ' O ' ' HG3' ' A' ' 117' ' ' GLU . 98.4 mttt -60.02 -39.49 86.02 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.808 177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.44 ' HA ' ' OE2' ' A' ' 117' ' ' GLU . 94.6 m -60.03 -40.01 87.88 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.029 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.812 ' HD3' HG21 ' A' ' 129' ' ' THR . 32.3 tpt180 -59.99 -45.41 92.81 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.46 0.648 . . . . 0.0 109.352 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -68.94 -34.54 75.52 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.854 -1.066 . . . . 0.0 108.739 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.679 ' HG3' ' O ' ' A' ' 113' ' ' LYS . 42.8 mt-10 -59.96 -40.07 87.8 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.201 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.459 ' NH2' ' HB2' ' A' ' 54' ' ' HIS . 20.8 ttm-85 -99.96 140.05 34.74 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 111.9 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -76.58 -20.39 56.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.411 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.649 HG21 ' CZ ' ' A' ' 115' ' ' ARG . 12.7 t 43.28 -171.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.907 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 98.4 mmm -150.68 159.99 44.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.33 123.76 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.498 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.533 ' O ' ' HB3' ' A' ' 126' ' ' HIS . 85.6 t60 -62.96 -41.34 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.835 0.35 . . . . 0.0 110.432 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 57.1 m -60.14 -39.96 88.14 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.71 -24.25 48.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.583 ' HA ' ' NH2' ' A' ' 115' ' ' ARG . 58.3 t-80 -66.16 -42.4 89.06 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.763 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.18 -40.56 94.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.556 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 51.4 tp10 -60.86 -42.56 98.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.275 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.812 HG21 ' HD3' ' A' ' 115' ' ' ARG . 94.3 m -68.47 -46.31 70.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.177 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -59.97 -42.73 94.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.152 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.03 -39.41 94.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.108 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.411 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 86.2 t60 -59.82 -44.85 93.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.901 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.851 ' HA ' HD12 ' A' ' 136' ' ' LEU . 42.2 mm -68.15 -40.13 82.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.786 0.327 . . . . 0.0 110.742 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.75 -41.45 92.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.59 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.698 ' O ' HD23 ' A' ' 139' ' ' LEU . 86.5 tt0 -62.85 -40.45 97.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.2 0.524 . . . . 0.0 110.943 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 133' ' ' ILE . 7.7 mt -60.04 -39.92 87.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.936 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -61.86 -40.04 94.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.843 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -61.66 -39.97 93.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.837 0.351 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 135' ' ' GLU . 3.5 mm? -67.09 -39.76 86.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.476 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.709 ' HZ2' ' HB3' ' A' ' 104' ' ' LYS . 4.5 m0 -59.95 -41.65 92.33 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.545 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -60.03 -45.02 94.19 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.448 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.651 ' O ' HD13 ' A' ' 146' ' ' LEU . 94.3 mt -62.97 -41.57 99.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.988 0.423 . . . . 0.0 110.626 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.779 HD13 ' HD2' ' A' ' 72' ' ' LYS . 93.3 mt -60.09 -39.99 88.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.128 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 140' ' ' TRP . 90.0 mt -60.09 -48.58 81.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.709 ' O ' ' HG3' ' A' ' 149' ' ' GLU . 86.5 tt0 -60.03 -39.62 86.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.361 176.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.987 HD23 HD13 ' A' ' 76' ' ' LEU . 5.9 mp -58.91 -40.12 83.57 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 114.861 -1.063 . . . . 0.0 112.001 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.74 HG22 ' CD2' ' A' ' 94' ' ' HIS . 0.8 OUTLIER -66.91 -46.25 75.41 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.195 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.68 -34.64 76.1 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.399 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.709 ' HG3' ' O ' ' A' ' 145' ' ' GLU . 47.6 mt-10 -59.99 -46.57 89.05 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.388 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.826 ' HE3' ' HG3' ' A' ' 90' ' ' LYS . 36.3 ttpt -60.48 -41.09 93.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.486 0.66 . . . . 0.0 110.485 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.864 ' HA2' ' HD2' ' A' ' 90' ' ' LYS . . . -59.91 -39.96 96.23 Favored Glycine 0 CA--C 1.506 -0.481 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.029 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -60.55 -41.25 94.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -70.03 -19.95 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.762 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.646 HD22 ' HD3' ' A' ' 90' ' ' LYS . 32.3 tp -67.88 -25.58 65.58 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.022 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 8.7 mp -69.11 137.03 53.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.369 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.85 -179.835 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.6 mtm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 59.95 37.07 21.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -76.1 142.79 41.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.685 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -85.98 117.93 69.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.758 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.5 135.7 50.85 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.465 2.11 . . . . 0.0 112.15 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -76.79 129.98 37.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.653 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -99.52 131.96 45.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.735 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 60.7 m -78.98 130.0 35.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.906 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 32.6 t -91.24 129.02 42.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.13 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.7 m -77.21 138.56 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.879 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -83.27 24.42 0.81 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -70.57 -40.02 73.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.974 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.5 m -73.46 133.0 43.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.218 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -88.7 132.14 11.07 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.594 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.442 ' O ' ' HG3' ' A' ' 16' ' ' LYS . 36.2 Cg_endo -65.0 144.58 82.93 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.729 2.286 . . . . 0.0 112.371 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 97.9 mttt -158.41 120.07 3.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.83 133.22 30.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.173 0.511 . . . . 0.0 111.679 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.28 127.5 33.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.09 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.934 ' HG3' HD11 ' A' ' 24' ' ' ILE . 86.2 tt0 -122.42 109.72 14.74 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.727 ' HB ' ' HB2' ' A' ' 23' ' ' GLU . 2.2 m -115.84 148.07 40.34 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.032 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.491 ' O ' ' CB ' ' A' ' 25' ' ' GLN . . . -67.16 -49.46 64.68 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.865 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 20.3 pt-20 -72.44 -41.53 66.04 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.612 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.727 ' HB2' ' HB ' ' A' ' 20' ' ' THR . 98.7 mt-10 -62.37 -47.06 85.85 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 118.871 -1.132 . . . . 0.0 109.511 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.934 HD11 ' HG3' ' A' ' 19' ' ' GLU . 89.9 mt -69.0 -45.62 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.747 177.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.678 ' HA ' ' CD ' ' A' ' 28' ' ' ARG . 59.2 tt0 -60.1 -40.01 88.18 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.372 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 22' ' ' GLU . 75.0 mm-40 -66.88 -50.12 63.48 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.581 0.705 . . . . 0.0 110.617 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.781 ' O ' HG23 ' A' ' 31' ' ' VAL . 94.9 mtt-85 -69.28 -37.15 77.72 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.811 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.678 ' CD ' ' HA ' ' A' ' 25' ' ' GLN . 8.3 ptm180 -63.97 -39.99 95.38 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.972 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 33' ' ' THR . 70.7 tp60 -59.95 -46.93 87.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.784 0.326 . . . . 0.0 110.163 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.46 ' HG2' ' HE ' ' A' ' 34' ' ' ARG . 76.5 tt0 -63.3 -46.45 86.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.331 0.586 . . . . 0.0 110.712 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 27' ' ' ARG . 96.9 t -60.05 -40.95 84.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.226 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.1 tp -59.99 -46.38 89.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.185 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 29' ' ' GLN . 35.3 p -67.22 -40.18 86.37 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 110.958 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.46 ' HE ' ' HG2' ' A' ' 30' ' ' GLU . 94.7 mtt-85 -65.95 -39.91 90.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.866 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.708 ' CE2' ' HE3' ' A' ' 39' ' ' LYS . 65.2 t80 -59.92 -49.54 77.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.202 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 72.4 tp60 -63.12 -39.97 96.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.059 0.457 . . . . 0.0 110.77 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.6 t -61.23 -39.85 91.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.93 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.67 -50.22 74.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.708 ' HE3' ' CE2' ' A' ' 35' ' ' TYR . 23.2 mttm -62.87 -38.19 89.89 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.946 176.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -59.96 -41.9 92.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.703 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.23 -40.07 94.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.978 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.77 -41.76 90.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.809 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.42 -42.48 96.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.06 -44.53 94.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.923 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 27.2 ttt180 -59.96 -40.08 87.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.13 148.04 17.08 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.231 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -78.75 116.95 19.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.81 0.338 . . . . 0.0 110.703 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -89.46 118.99 29.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.454 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.491 ' HG ' ' HB2' ' A' ' 51' ' ' ASP . 46.2 tp -70.01 -40.04 75.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.957 0.408 . . . . 0.0 110.914 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 46.47 17.63 0.05 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.491 ' HB2' ' HG ' ' A' ' 49' ' ' LEU . 98.9 m-20 -90.32 -73.05 0.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.954 0.407 . . . . 0.0 111.253 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.1 p -70.0 134.39 48.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.247 0.546 . . . . 0.0 111.346 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 57' ' ' VAL . 6.4 t80 -65.66 -19.0 65.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.993 178.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.442 ' CB ' ' HD2' ' A' ' 118' ' ' ARG . 76.7 m80 -60.02 -38.63 83.24 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.428 -0.805 . . . . 0.0 112.049 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.95 -44.97 94.06 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 60' ' ' ARG . 28.9 mm100 -67.14 -35.9 80.72 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.875 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 53' ' ' TYR . 99.9 t -63.5 -49.3 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.57 ' HA ' ' OD2' ' A' ' 61' ' ' ASP . 68.1 t80 -60.06 -39.98 87.88 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.025 -1.443 . . . . 0.0 108.047 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.848 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 56' ' ' GLN . 80.0 mtt180 -64.46 -41.73 96.34 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.422 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.575 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.8 p30 -62.49 -40.04 95.42 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.882 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . -59.94 -41.68 92.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.707 0.289 . . . . 0.0 111.532 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 96.1 m-20 -70.31 -49.59 47.96 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.563 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 86.0 m-20 -60.01 -36.21 76.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.449 177.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.95 -49.35 78.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.627 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.55 -33.01 83.3 Favored Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 63' ' ' ASP . 98.1 mttt -60.72 -41.29 94.97 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.091 0.472 . . . . 0.0 110.955 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.744 ' HE1' ' HB3' ' A' ' 100' ' ' GLU . 44.9 t90 -59.94 -41.26 91.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.032 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.916 ' O ' HG13 ' A' ' 73' ' ' VAL . 96.5 mt -66.52 -41.31 88.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.271 0.558 . . . . 0.0 110.325 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.773 ' O ' HG22 ' A' ' 73' ' ' VAL . 67.5 mtt -60.05 -32.92 71.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.249 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.457 ' OE1' ' HA ' ' A' ' 71' ' ' GLU . 9.8 mm-40 -64.72 -49.08 72.25 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.908 ' HD3' HD13 ' A' ' 143' ' ' LEU . 0.7 OUTLIER -65.82 -33.63 76.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.513 178.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.916 HG13 ' O ' ' A' ' 69' ' ' ILE . 3.0 m -68.28 -40.07 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.657 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -61.11 -49.93 75.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.733 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 19.3 tt -66.29 -36.9 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 3.1 tm? -60.06 -41.54 92.59 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.13 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.627 ' O ' ' HB3' ' A' ' 80' ' ' SER . 91.5 m -68.6 -26.82 65.56 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.273 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 65.9 t0 -60.13 -48.06 83.3 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.467 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LEU . 9.9 pttp -61.87 -23.88 66.57 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.627 ' HB3' ' O ' ' A' ' 77' ' ' THR . 22.9 t -60.7 -41.16 94.63 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.499 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.42 ' HB3' ' OD2' ' A' ' 83' ' ' ASP . 66.2 m-85 -60.03 -39.99 87.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.699 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 62.06 19.97 11.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.108 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' HB2' ' HD3' ' A' ' 84' ' ' PRO . 4.5 m-20 -71.2 -59.2 3.46 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.572 0.225 . . . . 0.0 110.668 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' A' ' 83' ' ' ASP . 94.5 Cg_endo -82.98 151.84 14.27 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.688 2.259 . . . . 0.0 112.262 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.5 m -83.21 122.02 27.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.852 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -76.67 153.94 34.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.359 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.0 pt -155.08 -162.02 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.74 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 94.3 mt-30 -59.93 -40.08 87.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.096 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.96 -45.28 94.44 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.443 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HE2' ' HZ1' ' A' ' 150' ' ' LYS . 15.2 tptm -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.138 0.494 . . . . 0.0 109.895 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' CD1' HD13 ' A' ' 154' ' ' LEU . 18.5 t80 -60.06 -40.05 88.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.81 178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 88' ' ' GLN . 77.3 mt-30 -60.0 -40.0 87.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.242 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -60.03 -40.31 88.9 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.41 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -67.08 -40.05 86.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.053 0.454 . . . . 0.0 110.304 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 98' ' ' GLU . 97.0 mt-30 -59.99 -43.35 95.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.507 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.3 m -60.84 -41.32 95.57 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 121.345 0.593 . . . . 0.0 110.281 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.809 ' O ' HG23 ' A' ' 101' ' ' VAL . 8.4 tt -70.03 -19.53 63.3 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.717 177.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.673 ' HB3' ' O ' ' A' ' 95' ' ' GLN . 51.3 tp10 -62.94 -44.21 96.7 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.59 86.52 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.322 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.744 ' HB3' ' HE1' ' A' ' 68' ' ' TRP . 99.2 mt-10 -61.86 -38.79 89.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.397 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 97' ' ' LEU . 48.1 t -60.02 -50.92 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.32 -39.73 95.36 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.242 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -63.38 -44.69 94.01 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.72 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.745 ' CE ' ' HA ' ' A' ' 65' ' ' LEU . 49.4 tptt -60.05 -39.96 87.77 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.422 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.692 ' O ' ' HB3' ' A' ' 108' ' ' MET . 33.4 t -57.28 -39.53 75.87 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.633 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 109' ' ' SER . 98.4 mtt180 -65.52 -38.11 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.501 0.667 . . . . 0.0 109.319 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 104' ' ' LYS . 62.3 tp -60.01 -31.55 70.04 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.746 ' CG ' HD11 ' A' ' 133' ' ' ILE . 49.2 ttp -66.59 -39.74 88.57 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 176.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 106' ' ' ARG . 24.0 t -64.66 -50.28 67.68 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.412 -1.267 . . . . 0.0 109.33 178.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.405 ' O ' ' N ' ' A' ' 114' ' ' THR . 70.2 mm-40 -63.18 -36.95 85.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.859 178.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 133' ' ' ILE . 4.0 tp -57.79 -42.56 84.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.76 -178.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.57 -42.87 73.94 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.976 0.893 . . . . 0.0 108.61 178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 117' ' ' GLU . 60.1 mttp -60.01 -36.0 76.27 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 113.996 -1.456 . . . . 0.0 109.938 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 93.6 m -60.04 -44.2 94.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.272 -178.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD3' ' CD2' ' A' ' 126' ' ' HIS . 53.9 ttm-85 -61.6 -44.49 96.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.71 0.767 . . . . 0.0 109.354 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -67.43 -31.08 71.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.687 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 114' ' ' THR . 86.4 tt0 -58.11 -40.01 80.1 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.76 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 54' ' ' HIS . 64.6 mtp85 -87.7 -171.45 3.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.383 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -77.91 133.82 38.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.857 0.361 . . . . 0.0 110.069 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.91 118.72 21.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.64 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 67.5 mtt -153.04 159.57 42.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.398 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 59.33 86.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.269 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.599 ' O ' ' HB2' ' A' ' 126' ' ' HIS . 92.2 m-70 -63.3 -39.94 95.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.737 0.303 . . . . 0.0 111.078 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.7 t -59.94 -40.0 87.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.736 0.303 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.25 -23.84 57.39 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 60.6 m170 -67.25 -42.49 83.86 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.841 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -59.96 -42.34 93.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.625 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -60.57 -47.88 84.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.851 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.4 m -68.52 -45.08 73.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 134' ' ' GLU . 98.6 mttt -60.09 -41.08 91.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.439 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.56 -40.69 76.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.878 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.783 ' O ' HD13 ' A' ' 136' ' ' LEU . 83.2 t60 -59.99 -46.96 87.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.684 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.746 HD11 ' CG ' ' A' ' 108' ' ' MET . 14.7 tt -66.65 -40.02 85.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.984 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.739 ' O ' ' HG2' ' A' ' 137' ' ' ARG . 45.1 mt-10 -61.44 -40.14 93.36 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.723 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -67.78 -40.15 83.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.078 0.466 . . . . 0.0 110.687 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.915 HD23 HD23 ' A' ' 65' ' ' LEU . 2.7 mp -66.98 -39.94 87.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.884 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.739 ' HG2' ' O ' ' A' ' 134' ' ' GLU . 37.1 ptt180 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.682 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -59.97 -42.94 95.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.049 0.452 . . . . 0.0 110.216 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 69' ' ' ILE . 64.8 tp -62.05 -39.93 94.03 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.645 ' HH2' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -58.35 -41.71 85.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.345 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -59.98 -45.69 91.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.81 0.338 . . . . 0.0 110.266 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 59.1 tp -59.95 -44.92 94.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.364 0.602 . . . . 0.0 109.973 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.908 HD13 ' HD3' ' A' ' 72' ' ' LYS . 83.1 mt -59.97 -40.0 87.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.636 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.457 HD21 HG11 ' A' ' 101' ' ' VAL . 82.4 mt -59.98 -48.12 83.02 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.29 -40.0 88.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.428 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 143' ' ' LEU . 84.3 mt -60.33 -40.32 90.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.581 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 94.3 m -67.58 -47.08 70.8 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.638 0.732 . . . . 0.0 109.157 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.4 mt -59.93 -39.42 85.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.075 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -60.03 -42.79 95.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.105 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.685 ' HZ1' ' HE2' ' A' ' 90' ' ' LYS . 57.4 tttt -62.27 -42.35 99.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.045 0.45 . . . . 0.0 111.228 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.716 ' O ' ' HG ' ' A' ' 155' ' ' LEU . . . -59.41 -29.85 67.05 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.926 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.0 -49.17 78.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -68.5 -32.21 72.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.556 HD13 ' CD1' ' A' ' 91' ' ' TYR . 84.2 mt -69.29 -24.86 64.01 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.496 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 151' ' ' GLY . 91.1 mt -62.8 132.45 52.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.912 0.387 . . . . 0.0 110.904 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.926 179.787 . . . . . . . . 0 0 . 1 stop_ save_